AB00111748-01
TL;DR: AB00111748-01 (CAS 429651-70-7) is a chemical compound with molecular formula C17H15ClFN5O3 and molecular weight 391.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-fluorophenyl)-2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]acetamide
Also Known As: AB00111748-01, N-(3-chloro-4-fluorophenyl)-2-[5-(3,4-dimethoxyphenyl)-2H-tetrazol-2-yl]acetamide, N-(3-chloro-4-fluorophenyl)-2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]acetamide
| Molecular Formula | C17H15ClFN5O3 |
|---|---|
| Molecular Weight | 391.08 g/mol |
| LogP | 2.7885 |
| Topological Polar Surface Area | 91.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 391.08475 |
| Heavy Atoms | 27 |
| Complexity | 978.95276 |
Chemical Identifiers
| CAS Number | 429651-70-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NN(N=N2)CC(=O)NC3=CC(=C(C=C3)F)Cl)OC |
Product Overview
AB00111748-01 (CAS 429651-70-7), with molecular formula C17H15ClFN5O3 and molecular weight 391.08 g/mol. IUPAC: N-(3-chloro-4-fluorophenyl)-2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]acetamide.
Chemical Property Profile of AB00111748-01
Property Insights of AB00111748-01
The XLogP value of 2.7885 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00111748-01. The TPSA of 91.16 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00111748-01. Following Lipinski's Rule of Five, AB00111748-01 has 1 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 AB00111748-01?
The CAS number of AB00111748-01 is 429651-70-7.
What is the molecular formula of AB00111748-01?
The molecular formula of AB00111748-01 is C17H15ClFN5O3.
What is the molecular weight of AB00111748-01?
The molecular weight of AB00111748-01 is 391.08 g/mol.
Where can I buy AB00111748-01?
You can request a quote for AB00111748-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00111748-01?
Yes, KEHONG BIO provides custom synthesis services for AB00111748-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.