AB00091472-01
TL;DR: AB00091472-01 (CAS 353775-66-3) is a chemical compound with molecular formula C24H23F3N2O3 and molecular weight 444.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-methoxyphenyl)-9,9-dimethyl-5-(2,2,2-trifluoroacetyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: AB00091472-01, 6-(4-methoxyphenyl)-9,9-dimethyl-5-(2,2,2-trifluoroacetyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one, 11-(4-methoxyphenyl)-3,3-dimethyl-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
| Molecular Formula | C24H23F3N2O3 |
|---|---|
| Molecular Weight | 444.17 g/mol |
| LogP | 5.4005 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 444.16608 |
| Heavy Atoms | 32 |
| Complexity | 1104.2177 |
Chemical Identifiers
| CAS Number | 353775-66-3 |
|---|---|
| SMILES | CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C(F)(F)F)C4=CC=C(C=C4)OC)C(=O)C1)C |
Product Overview
AB00091472-01 (CAS 353775-66-3), with molecular formula C24H23F3N2O3 and molecular weight 444.17 g/mol. IUPAC: 6-(4-methoxyphenyl)-9,9-dimethyl-5-(2,2,2-trifluoroacetyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of AB00091472-01
Property Insights of AB00091472-01
The XLogP value of 5.4005 indicates that AB00091472-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, AB00091472-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00091472-01 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00091472-01?
The CAS number of AB00091472-01 is 353775-66-3.
What is the molecular formula of AB00091472-01?
The molecular formula of AB00091472-01 is C24H23F3N2O3.
What is the molecular weight of AB00091472-01?
The molecular weight of AB00091472-01 is 444.17 g/mol.
Where can I buy AB00091472-01?
You can request a quote for AB00091472-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00091472-01?
Yes, KEHONG BIO provides custom synthesis services for AB00091472-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.