V024-9662 Screening compound: N-tert-butyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(4-methylbenzenesulfonamido)phenyl)-1,4-diazepane-1-carboxamide

V024-9662 Screening compound: N-tert-butyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(4-methylbenzenesulfonamido)phenyl)-1,4-diazepane-1-carboxamide
V024-9662 Screening compound: N-tert-butyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(4-methylbenzenesulfonamido)phenyl)-1,4-diazepane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-9662
N-tert-butyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(4-methylbenzenesulfonamido)phenyl)-1,4-diazepane-1-carboxamide

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

V024-9662

Molecular Formula

C31H38FN5O4S (C31 H38 FN5 O4 S)

Compound Name

N-tert-butyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(4-methylbenzenesulfonamido)phenyl)-1,4-diazepane-1-carboxamide

IUPAC name

N-tert-butyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(4-methylbenzenesulfonamido)phenyl)-14-diazepane-1-carboxamide

SMILES

CC(C)(C)NC(N(CCC1)CCN1c(ccc(NS(c1ccc(C)cc1)(=O)=O)c1)c1C(NCc(cc1)ccc1F)=O)=O

InChI

InChI=1S/C31H38FN5O4S/c1-22-6-13-26(14-7-22)42(40,41)35-25-12-15-28(27(20-25)29(38)33-21-23-8-10-24(32)11-9-23)36-16-5-17-37(19-18-36)30(39)34-31(2,3)4/h6-15,20,35H,5,16-19,21H2,1-4H3,(H,33,38)(H,34,39)

InChI Key

PSTLYVWVKNHWGA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14259554

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

595.74

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.510

Distribution Coefficient, logD

5.407

Water Solubility, LogSw

-5.37

Polar Surface Area

94.478

Acid Dissociation Constant (pKa)

8.26

Base Dissociation Constant (pKb)

6.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.50

References: we are preparing a list of scientific research reports with V024-9662 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-9662?
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What is the minimum amount of V024-9662 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-9662
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-9662
  • 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 V024-9662 available by request