3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide
TL;DR: 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide (CAS 300686-10-6) is a chemical compound with molecular formula C13H16N4O2S and molecular weight 292.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(3-amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide
Also Known As: BIM-0025282.P001, AB00090008-01, AH-034/10835021, 3,3'-(2-thioxo-1H-benzimidazole-1,3(2H)-diyl)dipropanamide, 3-[3-(3-amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide
| Molecular Formula | C13H16N4O2S |
|---|---|
| Molecular Weight | 292.10 g/mol |
| LogP | 0.92309 |
| Topological Polar Surface Area | 96.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 292.0994 |
| Heavy Atoms | 20 |
| Complexity | 658.7197 |
Chemical Identifiers
| CAS Number | 300686-10-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N(C(=S)N2CCC(=O)N)CCC(=O)N |
Product Overview
3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide (CAS 300686-10-6), with molecular formula C13H16N4O2S and molecular weight 292.10 g/mol. IUPAC: 3-[3-(3-amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide.
Chemical Property Profile of 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide
Property Insights of 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide
The XLogP value of 0.92309 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide. The TPSA of 96.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide. Following Lipinski's Rule of Five, 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide has 2 hydrogen bond donor(s) and 3 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 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide?
The CAS number of 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide is 300686-10-6.
What is the molecular formula of 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide?
The molecular formula of 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide is C13H16N4O2S.
What is the molecular weight of 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide?
The molecular weight of 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide is 292.10 g/mol.
Where can I buy 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide?
You can request a quote for 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-[3-(3-Amino-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.