D751-0192 Screening compound: (2S,3R)-2-({2-[(13bR)-14-methyl-5-oxo-7,8,13b,14-tetrahydroquinazolino[2,3-a]beta-carbolin-13(5H)-yl]acetyl}amino)-3-methylpentanoic acid

D751-0192 Screening compound: (2S,3R)-2-({2-[(13bR)-14-methyl-5-oxo-7,8,13b,14-tetrahydroquinazolino[2,3-a]beta-carbolin-13(5H)-yl]acetyl}amino)-3-methylpentanoic acid
D751-0192 Screening compound: (2S,3R)-2-({2-[(13bR)-14-methyl-5-oxo-7,8,13b,14-tetrahydroquinazolino[2,3-a]beta-carbolin-13(5H)-yl]acetyl}amino)-3-methylpentanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound D751-0192
(2S,3R)-2-({2-[(13bR)-14-methyl-5-oxo-7,8,13b,14-tetrahydroquinazolino[2,3-a]beta-carbolin-13(5H)-yl]acetyl}amino)-3-methylpentanoic acid

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

D751-0192

Molecular Formula

C27H30N4O4 (C27 H30 N4 O4)

Compound Name

(2S,3R)-2-({2-[(13bR)-14-methyl-5-oxo-7,8,13b,14-tetrahydroquinazolino[2,3-a]beta-carbolin-13(5H)-yl]acetyl}amino)-3-methylpentanoic acid

IUPAC name

(2S3R)-3-methyl-2-{2-[(1R)-21-methyl-14-oxo-31321-triazapentacyclo[11.8.0.0^{210}.0^{49}.0^{1520}]henicosa-2(10)4(9)5715(20)1618-heptaen-3-yl]acetamido}pentanoic acid

SMILES

CC[C@@H](C)[C@@H](C(O)=O)NC(Cn1c(cccc2)c2c(CC2)c1[C@H](N(C)c1c3cccc1)N2C3=O)=O

InChI

InChI=1S/C27H30N4O4/c1-4-16(2)23(27(34)35)28-22(32)15-31-21-12-8-5-9-17(21)18-13-14-30-25(24(18)31)29(3)20-11-7-6-10-19(20)26(30)33/h5-12,16,23,25H,4,13-15H2,1-3H3,(H,28,32)(H,34,35)/t16-,23+,25-/m1/s1

InChI Key

IMVWAJXNWCDNLY-PWBHZWRTSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.440

Distribution Coefficient, logD

-1.189

Water Solubility, LogSw

-2.84

Polar Surface Area

71.009

Acid Dissociation Constant (pKa)

3.77

Base Dissociation Constant (pKb)

1.72

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

37.04

D751-0192 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Natural-Product-Based Library (3730 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Structure:
  • Pool

References: we are preparing a list of scientific research reports with D751-0192 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D751-0192?
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What is the minimum amount of D751-0192 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D751-0192
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D751-0192
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of D751-0192 available by request