ASN 14402022
TL;DR: ASN 14402022 (CAS 879047-21-9) is a chemical compound with molecular formula C27H25FN2O4 and molecular weight 460.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(4-fluorophenyl)-6-(4-hydroxy-3,5-dimethoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: ASN 14402022, 3-(4-fluorophenyl)-11-(4-hydroxy-3,5-dimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 9-(4-fluorophenyl)-6-(4-hydroxy-3,5-dimethoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
| Molecular Formula | C27H25FN2O4 |
|---|---|
| Molecular Weight | 460.18 g/mol |
| LogP | 5.528 |
| Topological Polar Surface Area | 79.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 460.17984 |
| Heavy Atoms | 34 |
| Complexity | 1261.0376 |
Chemical Identifiers
| CAS Number | 879047-21-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)OC)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)F)NC5=CC=CC=C5N2 |
Product Overview
ASN 14402022 (CAS 879047-21-9), with molecular formula C27H25FN2O4 and molecular weight 460.18 g/mol. IUPAC: 9-(4-fluorophenyl)-6-(4-hydroxy-3,5-dimethoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of ASN 14402022
Property Insights of ASN 14402022
The XLogP value of 5.528 indicates that ASN 14402022 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.82 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 14402022. Following Lipinski's Rule of Five, ASN 14402022 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ASN 14402022?
The CAS number of ASN 14402022 is 879047-21-9.
What is the molecular formula of ASN 14402022?
The molecular formula of ASN 14402022 is C27H25FN2O4.
What is the molecular weight of ASN 14402022?
The molecular weight of ASN 14402022 is 460.18 g/mol.
Where can I buy ASN 14402022?
You can request a quote for ASN 14402022 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 14402022?
Yes, KEHONG BIO provides custom synthesis services for ASN 14402022 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.