AB00672181-01
TL;DR: AB00672181-01 (CAS 906147-32-8) is a chemical compound with molecular formula C18H16N6O3S and molecular weight 396.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-2-[3-(3-methoxyphenyl)triazolo[4,5-d]pyrimidin-7-yl]sulfanylacetamide
Also Known As: AB00672181-01, F0682-1072, N-(furan-2-ylmethyl)-2-((3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)thio)acetamide, N-[(furan-2-yl)methyl]-2-{[3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamide, N-(furan-2-ylmethyl)-2-[3-(3-methoxyphenyl)triazolo[4,5-d]pyrimidin-7-yl]sulfanylacetamide
| Molecular Formula | C18H16N6O3S |
|---|---|
| Molecular Weight | 396.10 g/mol |
| LogP | 2.2206 |
| Topological Polar Surface Area | 107.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 396.10046 |
| Heavy Atoms | 28 |
| Complexity | 1095.8604 |
Chemical Identifiers
| CAS Number | 906147-32-8 |
|---|---|
| SMILES | COC1=CC=CC(=C1)N2C3=C(C(=NC=N3)SCC(=O)NCC4=CC=CO4)N=N2 |
Product Overview
AB00672181-01 (CAS 906147-32-8), with molecular formula C18H16N6O3S and molecular weight 396.10 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-[3-(3-methoxyphenyl)triazolo[4,5-d]pyrimidin-7-yl]sulfanylacetamide.
Chemical Property Profile of AB00672181-01
Property Insights of AB00672181-01
The XLogP value of 2.2206 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00672181-01. The TPSA of 107.96 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00672181-01. Following Lipinski's Rule of Five, AB00672181-01 has 1 hydrogen bond donor(s) and 8 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 AB00672181-01?
The CAS number of AB00672181-01 is 906147-32-8.
What is the molecular formula of AB00672181-01?
The molecular formula of AB00672181-01 is C18H16N6O3S.
What is the molecular weight of AB00672181-01?
The molecular weight of AB00672181-01 is 396.10 g/mol.
Where can I buy AB00672181-01?
You can request a quote for AB00672181-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00672181-01?
Yes, KEHONG BIO provides custom synthesis services for AB00672181-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.