AP-970/42736390
TL;DR: AP-970/42736390 (CAS 708241-73-0) is a chemical compound with molecular formula C22H17ClN4O4 and molecular weight 436.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3-chloro-4-methoxyphenyl)-6-methylbenzotriazol-5-yl]-1,3-benzodioxole-5-carboxamide
Also Known As: AP-970/42736390, N-[2-(3-chloro-4-methoxyphenyl)-6-methylbenzotriazol-5-yl]-1,3-benzodioxole-5-carboxamide, N-[2-(3-chloro-4-methoxyphenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-1,3-benzodioxole-5-carboxamide, N-[2-(3-chloro-4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-1,3-benzodioxole-5-carboxamide
| Molecular Formula | C22H17ClN4O4 |
|---|---|
| Molecular Weight | 436.09 g/mol |
| LogP | 4.37192 |
| Topological Polar Surface Area | 87.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 436.09384 |
| Heavy Atoms | 31 |
| Complexity | 1334.8378 |
Chemical Identifiers
| CAS Number | 708241-73-0 |
|---|---|
| SMILES | CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC4=C(C=C3)OCO4)C5=CC(=C(C=C5)OC)Cl |
Product Overview
AP-970/42736390 (CAS 708241-73-0), with molecular formula C22H17ClN4O4 and molecular weight 436.09 g/mol. IUPAC: N-[2-(3-chloro-4-methoxyphenyl)-6-methylbenzotriazol-5-yl]-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of AP-970/42736390
Property Insights of AP-970/42736390
The XLogP value of 4.37192 indicates that AP-970/42736390 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.5 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-970/42736390. Following Lipinski's Rule of Five, AP-970/42736390 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 AP-970/42736390?
The CAS number of AP-970/42736390 is 708241-73-0.
What is the molecular formula of AP-970/42736390?
The molecular formula of AP-970/42736390 is C22H17ClN4O4.
What is the molecular weight of AP-970/42736390?
The molecular weight of AP-970/42736390 is 436.09 g/mol.
Where can I buy AP-970/42736390?
You can request a quote for AP-970/42736390 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42736390?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42736390 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.