D277-1898F Screening compound: 5-[2-(4-chlorophenyl)-2-oxoethyl]-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one

D277-1898F Screening compound: 5-[2-(4-chlorophenyl)-2-oxoethyl]-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
D277-1898F Screening compound: 5-[2-(4-chlorophenyl)-2-oxoethyl]-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D277-1898F
5-[2-(4-chlorophenyl)-2-oxoethyl]-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one

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

D277-1898F

Molecular Formula

C18H17ClN2O2 (C18 H17 ClN2 O2)

Compound Name

5-[2-(4-chlorophenyl)-2-oxoethyl]-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one

IUPAC name

n/a

SMILES

CC(C1)N(CC(c(cc2)ccc2Cl)=O)c(cccc2)c2NC1=O

InChI

InChI=1S/C18H17ClN2O2/c1-12-10-18(23)20-15-4-2-3-5-16(15)21(12)11-17(22)13-6-8-14(19)9-7-13/h2-9,12H,10-11H2,1H3,(H,20,23)/t12-/m0/s1

InChI Key

JDXHEQAFWUTWLC-LBPRGKRZSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.8

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.104

Distribution Coefficient, logD

3.102

Water Solubility, LogSw

-3.69

Polar Surface Area

40.384

Acid Dissociation Constant (pKa)

9.68

Base Dissociation Constant (pKb)

5.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

D277-1898F in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with D277-1898F chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D277-1898F?
Check Price and Availability of D277-1898F, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D277-1898F you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D277-1898F
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D277-1898F
  • 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 D277-1898F available by request