ASN 14399959
TL;DR: ASN 14399959 (CAS 879044-61-8) is a chemical compound with molecular formula C26H23ClN2O3 and molecular weight 446.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(2-chlorophenyl)-6-(2-hydroxy-3-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: ASN 14399959, 3-(2-chlorophenyl)-11-(2-hydroxy-3-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 9-(2-chlorophenyl)-6-(2-hydroxy-3-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
| Molecular Formula | C26H23ClN2O3 |
|---|---|
| Molecular Weight | 446.14 g/mol |
| LogP | 6.0337 |
| Topological Polar Surface Area | 70.59 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 446.1397 |
| Heavy Atoms | 32 |
| Complexity | 1237.2466 |
Chemical Identifiers
| CAS Number | 879044-61-8 |
|---|---|
| SMILES | COC1=CC=CC(=C1O)C2C3=C(CC(CC3=O)C4=CC=CC=C4Cl)NC5=CC=CC=C5N2 |
Product Overview
ASN 14399959 (CAS 879044-61-8), with molecular formula C26H23ClN2O3 and molecular weight 446.14 g/mol. IUPAC: 9-(2-chlorophenyl)-6-(2-hydroxy-3-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of ASN 14399959
Property Insights of ASN 14399959
The XLogP value of 6.0337 indicates that ASN 14399959 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.59 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 14399959. Following Lipinski's Rule of Five, ASN 14399959 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ASN 14399959?
The CAS number of ASN 14399959 is 879044-61-8.
What is the molecular formula of ASN 14399959?
The molecular formula of ASN 14399959 is C26H23ClN2O3.
What is the molecular weight of ASN 14399959?
The molecular weight of ASN 14399959 is 446.14 g/mol.
Where can I buy ASN 14399959?
You can request a quote for ASN 14399959 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 14399959?
Yes, KEHONG BIO provides custom synthesis services for ASN 14399959 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.