A2944/0123989
TL;DR: A2944/0123989 (CAS 956370-56-2) is a chemical compound with molecular formula C19H17BrN4O3S and molecular weight 460.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(2-amino-2-oxoethyl)-3-benzyl-4-oxo-2-sulfanylideneimidazolidin-1-yl]-4-bromobenzamide
Also Known As: A2944/0123989, N-(5-(2-amino-2-oxoethyl)-3-benzyl-4-oxo-2-thioxoimidazolidin-1-yl)-4-bromobenzamide, N-[5-(2-amino-2-oxoethyl)-3-benzyl-4-oxo-2-thioxoimidazolidin-1-yl]-4-bromobenzamide, N-[3-BENZYL-5-(CARBAMOYLMETHYL)-4-OXO-2-SULFANYLIDENEIMIDAZOLIDIN-1-YL]-4-BROMOBENZAMIDE, N-[5-(2-amino-2-oxoethyl)-3-benzyl-4-oxo-2-sulfanylideneimidazolidin-1-yl]-4-bromobenzamide
| Molecular Formula | C19H17BrN4O3S |
|---|---|
| Molecular Weight | 460.02 g/mol |
| LogP | 1.9672 |
| Topological Polar Surface Area | 95.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 460.02048 |
| Heavy Atoms | 28 |
| Complexity | 920.5358 |
Chemical Identifiers
| CAS Number | 956370-56-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)C(N(C2=S)NC(=O)C3=CC=C(C=C3)Br)CC(=O)N |
Product Overview
A2944/0123989 (CAS 956370-56-2), with molecular formula C19H17BrN4O3S and molecular weight 460.02 g/mol. IUPAC: N-[5-(2-amino-2-oxoethyl)-3-benzyl-4-oxo-2-sulfanylideneimidazolidin-1-yl]-4-bromobenzamide.
Chemical Property Profile of A2944/0123989
Property Insights of A2944/0123989
The XLogP value of 1.9672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2944/0123989. The TPSA of 95.74 Ų falls within the moderate polarity range, balancing permeability and solubility for A2944/0123989. Following Lipinski's Rule of Five, A2944/0123989 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2944/0123989?
The CAS number of A2944/0123989 is 956370-56-2.
What is the molecular formula of A2944/0123989?
The molecular formula of A2944/0123989 is C19H17BrN4O3S.
What is the molecular weight of A2944/0123989?
The molecular weight of A2944/0123989 is 460.02 g/mol.
Where can I buy A2944/0123989?
You can request a quote for A2944/0123989 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2944/0123989?
Yes, KEHONG BIO provides custom synthesis services for A2944/0123989 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.