V028-9886 Screening compound: 4-(2-[(diethylamino)carbonyl]-4-{[(propylamino)carbonyl]amino}phenyl)-N-isopropyl-1,4-diazepane-1-carboxamide

V028-9886 Screening compound: 4-(2-[(diethylamino)carbonyl]-4-{[(propylamino)carbonyl]amino}phenyl)-N-isopropyl-1,4-diazepane-1-carboxamide
V028-9886 Screening compound: 4-(2-[(diethylamino)carbonyl]-4-{[(propylamino)carbonyl]amino}phenyl)-N-isopropyl-1,4-diazepane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-9886
4-(2-[(diethylamino)carbonyl]-4-{[(propylamino)carbonyl]amino}phenyl)-N-isopropyl-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

V028-9886

Molecular Formula

C24H40N6O3 (C24 H40 N6 O3)

Compound Name

4-(2-[(diethylamino)carbonyl]-4-{[(propylamino)carbonyl]amino}phenyl)-N-isopropyl-1,4-diazepane-1-carboxamide

IUPAC name

4-[2-(diethylcarbamoyl)-4-[(propylcarbamoyl)amino]phenyl]-N-(propan-2-yl)-14-diazepane-1-carboxamide

SMILES

CCCNC(Nc(cc1)cc(C(N(CC)CC)=O)c1N(CCC1)CCN1C(NC(C)C)=O)=O

InChI

InChI=1S/C24H40N6O3/c1-6-12-25-23(32)27-19-10-11-21(20(17-19)22(31)28(7-2)8-3)29-13-9-14-30(16-15-29)24(33)26-18(4)5/h10-11,17-18H,6-9,12-16H2,1-5H3,(H,26,33)(H2,25,27,32)

InChI Key

BWGLJYOOXCMICY-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

460.62

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.003

Distribution Coefficient, logD

2.989

Water Solubility, LogSw

-3.56

Polar Surface Area

79.236

Acid Dissociation Constant (pKa)

13.98

Base Dissociation Constant (pKb)

5.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

62.50

References: we are preparing a list of scientific research reports with V028-9886 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-9886?
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What is the minimum amount of V028-9886 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-9886
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-9886
  • 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 V028-9886 available by request