V018-6207 Screening compound: ethyl 1-ethyl-4-(3-methylphenyl)-2-oxo-6-{[4-(propylcarbamoyl)-1,4-diazepan-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V018-6207 Screening compound: ethyl 1-ethyl-4-(3-methylphenyl)-2-oxo-6-{[4-(propylcarbamoyl)-1,4-diazepan-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V018-6207 Screening compound: ethyl 1-ethyl-4-(3-methylphenyl)-2-oxo-6-{[4-(propylcarbamoyl)-1,4-diazepan-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-6207
ethyl 1-ethyl-4-(3-methylphenyl)-2-oxo-6-{[4-(propylcarbamoyl)-1,4-diazepan-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate

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

V018-6207

Molecular Formula

C26H39N5O4 (C26 H39 N5 O4)

Compound Name

ethyl 1-ethyl-4-(3-methylphenyl)-2-oxo-6-{[4-(propylcarbamoyl)-1,4-diazepan-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

ethyl 1-ethyl-4-(3-methylphenyl)-2-oxo-6-{[4-(propylcarbamoyl)-14-diazepan-1-yl]methyl}-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCCNC(N1CCN(CC(N(CC)C(NC2c3cc(C)ccc3)=O)=C2C(OCC)=O)CCC1)=O

InChI

InChI=1S/C26H39N5O4/c1-5-12-27-25(33)30-14-9-13-29(15-16-30)18-21-22(24(32)35-7-3)23(28-26(34)31(21)6-2)20-11-8-10-19(4)17-20/h8,10-11,17,23H,5-7,9,12-16,18H2,1-4H3,(H,27,33)(H,28,34)/t23-/m1/s1

InChI Key

SAVJMLLBKDHZKU-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD19813030

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

485.63

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.406

Distribution Coefficient, logD

-0.304

Water Solubility, LogSw

-3.45

Polar Surface Area

79.525

Acid Dissociation Constant (pKa)

10.01

Base Dissociation Constant (pKb)

9.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.70

References: we are preparing a list of scientific research reports with V018-6207 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-6207?
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What is the minimum amount of V018-6207 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-6207
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-6207
  • 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 V018-6207 available by request