C795-0632 Screening compound: N-[3-(diethylamino)propyl]-4-(6-methyl-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-4-oxobutanamide

C795-0632 Screening compound: N-[3-(diethylamino)propyl]-4-(6-methyl-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-4-oxobutanamide
C795-0632 Screening compound: N-[3-(diethylamino)propyl]-4-(6-methyl-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-4-oxobutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C795-0632
N-[3-(diethylamino)propyl]-4-(6-methyl-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-4-oxobutanamide

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

C795-0632

Molecular Formula

C20H31N3O3 (C20 H31 N3 O3)

Compound Name

N-[3-(diethylamino)propyl]-4-(6-methyl-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-4-oxobutanamide

IUPAC name

N-[3-(diethylamino)propyl]-4-(6-methyl-34-dihydro-2H-14-benzoxazin-4-yl)-4-oxobutanamide

SMILES

CCN(CC)CCCNC(CCC(N1c(cc(C)cc2)c2OCC1)=O)=O

InChI

InChI=1S/C20H31N3O3/c1-4-22(5-2)12-6-11-21-19(24)9-10-20(25)23-13-14-26-18-8-7-16(3)15-17(18)23/h7-8,15H,4-6,9-14H2,1-3H3,(H,21,24)

InChI Key

OLBPNYAMHWQZAD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14796996

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.733

Distribution Coefficient, logD

-1.046

Water Solubility, LogSw

-2.24

Polar Surface Area

50.971

Acid Dissociation Constant (pKa)

15.45

Base Dissociation Constant (pKb)

10.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

References: we are preparing a list of scientific research reports with C795-0632 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C795-0632?
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What is the minimum amount of C795-0632 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C795-0632
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C795-0632
  • 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 C795-0632 available by request