AB00679904-01
TL;DR: AB00679904-01 (CAS 905693-61-0) is a chemical compound with molecular formula C15H14N4O2S2 and molecular weight 346.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-methyl-1,3-benzothiazol-2-yl)-2-[(6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]acetamide
Also Known As: AB00679904-01, G856-8138, F2585-0193, N-(6-methyl-1,3-benzothiazol-2-yl)-2-[(6-methyl-2-oxo-1,2-dihydropyrimidin-4-yl)sulfanyl]acetamide, N-(6-methyl-1,3-benzothiazol-2-yl)-2-[(6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]acetamide
| Molecular Formula | C15H14N4O2S2 |
|---|---|
| Molecular Weight | 346.06 g/mol |
| LogP | 2.72724 |
| Topological Polar Surface Area | 87.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 346.05582 |
| Heavy Atoms | 23 |
| Complexity | 932.61676 |
Chemical Identifiers
| CAS Number | 905693-61-0 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC(=O)NC(=C3)C |
Product Overview
AB00679904-01 (CAS 905693-61-0), with molecular formula C15H14N4O2S2 and molecular weight 346.06 g/mol. IUPAC: N-(6-methyl-1,3-benzothiazol-2-yl)-2-[(6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]acetamide.
Chemical Property Profile of AB00679904-01
Property Insights of AB00679904-01
The XLogP value of 2.72724 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00679904-01. The TPSA of 87.74 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00679904-01. Following Lipinski's Rule of Five, AB00679904-01 has 2 hydrogen bond donor(s) and 6 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 AB00679904-01?
The CAS number of AB00679904-01 is 905693-61-0.
What is the molecular formula of AB00679904-01?
The molecular formula of AB00679904-01 is C15H14N4O2S2.
What is the molecular weight of AB00679904-01?
The molecular weight of AB00679904-01 is 346.06 g/mol.
Where can I buy AB00679904-01?
You can request a quote for AB00679904-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00679904-01?
Yes, KEHONG BIO provides custom synthesis services for AB00679904-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.