SB33-0270 Screening compound: N-[(3S,4R)-1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)carbonyl]-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-3-yl]benzamide

SB33-0270 Screening compound: N-[(3S,4R)-1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)carbonyl]-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-3-yl]benzamide
SB33-0270 Screening compound: N-[(3S,4R)-1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)carbonyl]-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-3-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB33-0270
N-[(3S,4R)-1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)carbonyl]-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-3-yl]benzamide

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

SB33-0270

Molecular Formula

C21H25N7O2 (C21 H25 N7 O2)

Compound Name

N-[(3S,4R)-1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)carbonyl]-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-3-yl]benzamide

IUPAC name

N-[(3S4R)-1-(1-ethyl-5-methyl-1H-pyrazole-4-carbonyl)-4-(3-methyl-1H-124-triazol-5-yl)pyrrolidin-3-yl]benzamide

SMILES

CCn1ncc(C(N(C[C@@H]2c3nc(C)n[nH]3)C[C@@H]2NC(c2ccccc2)=O)=O)c1C

InChI

InChI=1S/C21H25N7O2/c1-4-28-13(2)16(10-22-28)21(30)27-11-17(19-23-14(3)25-26-19)18(12-27)24-20(29)15-8-6-5-7-9-15/h5-10,17-18H,4,11-12H2,1-3H3,(H,24,29)(H,23,25,26)/t17-,18-/m0/s1

InChI Key

APMXUQQXYUQBGX-ROUUACIJSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.706

Distribution Coefficient, logD

0.706

Water Solubility, LogSw

-2.41

Polar Surface Area

88.779

Acid Dissociation Constant (pKa)

10.37

Base Dissociation Constant (pKb)

2.50

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

38.10

References: we are preparing a list of scientific research reports with SB33-0270 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB33-0270?
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What is the minimum amount of SB33-0270 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB33-0270
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB33-0270
  • 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 SB33-0270 available by request