V003-5184 Screening compound: N-{2-ETHYL-4-[2-(4-FLUOROPHENYL)ETHYL]-3-OXO-2,3,4,5-TETRAHYDRO-1,4-BENZOXAZEPIN-7-YL}-2-(3-METHOXYPHENYL)ACETAMIDE

V003-5184 Screening compound: N-{2-ETHYL-4-[2-(4-FLUOROPHENYL)ETHYL]-3-OXO-2,3,4,5-TETRAHYDRO-1,4-BENZOXAZEPIN-7-YL}-2-(3-METHOXYPHENYL)ACETAMIDE
V003-5184 Screening compound: N-{2-ETHYL-4-[2-(4-FLUOROPHENYL)ETHYL]-3-OXO-2,3,4,5-TETRAHYDRO-1,4-BENZOXAZEPIN-7-YL}-2-(3-METHOXYPHENYL)ACETAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-5184
N-{2-ETHYL-4-[2-(4-FLUOROPHENYL)ETHYL]-3-OXO-2,3,4,5-TETRAHYDRO-1,4-BENZOXAZEPIN-7-YL}-2-(3-METHOXYPHENYL)ACETAMIDE

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

V003-5184

Molecular Formula

C28H29FN2O4 (C28 H29 FN2 O4)

Compound Name

N-{2-ETHYL-4-[2-(4-FLUOROPHENYL)ETHYL]-3-OXO-2,3,4,5-TETRAHYDRO-1,4-BENZOXAZEPIN-7-YL}-2-(3-METHOXYPHENYL)ACETAMIDE

IUPAC name

n/a

SMILES

CCC(C(N(CCc(cc1)ccc1F)C1)=O)Oc(cc2)c1cc2NC(Cc1cc(OC)ccc1)=O

InChI

InChI=1S/C28H29FN2O4/c1-3-25-28(33)31(14-13-19-7-9-22(29)10-8-19)18-21-17-23(11-12-26(21)35-25)30-27(32)16-20-5-4-6-24(15-20)34-2/h4-12,15,17,25H,3,13-14,16,18H2,1-2H3,(H,30,32)/t25-/m0/s1

InChI Key

YMVPPWXVFOXOGV-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19854361

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.837

Distribution Coefficient, logD

4.837

Water Solubility, LogSw

-4.70

Polar Surface Area

55.175

Acid Dissociation Constant (pKa)

11.69

Base Dissociation Constant (pKb)

3.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with V003-5184 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-5184?
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What is the minimum amount of V003-5184 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-5184
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-5184
  • 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 V003-5184 available by request