Y600-4168 Screening compound: N-[3-(dimethylamino)propyl]-2-(3,3,11-trimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl)acetamide

Y600-4168 Screening compound: N-[3-(dimethylamino)propyl]-2-(3,3,11-trimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl)acetamide
Y600-4168 Screening compound: N-[3-(dimethylamino)propyl]-2-(3,3,11-trimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y600-4168
N-[3-(dimethylamino)propyl]-2-(3,3,11-trimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl)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

Y600-4168

Molecular Formula

C23H34N4O2 (C23 H34 N4 O2)

Compound Name

N-[3-(dimethylamino)propyl]-2-(3,3,11-trimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl)acetamide

IUPAC name

N-[3-(dimethylamino)propyl]-2-{101414-trimethyl-12-oxo-29-diazatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)46-tetraen-9-yl}acetamide

SMILES

CC1N(CC(NCCCN(C)C)=O)c(cccc2)c2NC(CC(C)(C)C2)=C1C2=O

InChI

InChI=1S/C23H34N4O2/c1-16-22-18(13-23(2,3)14-20(22)28)25-17-9-6-7-10-19(17)27(16)15-21(29)24-11-8-12-26(4)5/h6-7,9-10,16,25H,8,11-15H2,1-5H3,(H,24,29)/t16-/m0/s1

InChI Key

AKGOJBVCWNLASB-INIZCTEOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.109

Distribution Coefficient, logD

-0.363

Water Solubility, LogSw

-2.91

Polar Surface Area

54.893

Acid Dissociation Constant (pKa)

8.11

Base Dissociation Constant (pKb)

9.87

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

56.52

References: we are preparing a list of scientific research reports with Y600-4168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y600-4168?
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What is the minimum amount of Y600-4168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y600-4168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y600-4168
  • 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 Y600-4168 available by request