ChemDiv1_003795
TL;DR: ChemDiv1_003795 (CAS 353785-16-7) is a chemical compound with molecular formula C25H25F3N2O4 and molecular weight 474.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2,3-dimethoxyphenyl)-9,9-dimethyl-5-(2,2,2-trifluoroacetyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: ChemDiv1_003795, BAS 01355550, AB00133043-02, 11-(2,3-dimethoxyphenyl)-3,3-dimethyl-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 11-(2,3-DIMETHOXYPHENYL)-3,3-DIMETHYL-10-(2,2,2-TRIFLUOROACETYL)-2,3,4,5,10,11-HEXAHYDRO-1H-DIBENZO[B,E][1,4]DIAZEPIN-1-ONE
| Molecular Formula | C25H25F3N2O4 |
|---|---|
| Molecular Weight | 474.18 g/mol |
| LogP | 5.4091 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 474.17664 |
| Heavy Atoms | 34 |
| Complexity | 1186.9235 |
Chemical Identifiers
| CAS Number | 353785-16-7 |
|---|---|
| SMILES | CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C(F)(F)F)C4=C(C(=CC=C4)OC)OC)C(=O)C1)C |
Product Overview
ChemDiv1_003795 (CAS 353785-16-7), with molecular formula C25H25F3N2O4 and molecular weight 474.18 g/mol. IUPAC: 6-(2,3-dimethoxyphenyl)-9,9-dimethyl-5-(2,2,2-trifluoroacetyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of ChemDiv1_003795
Property Insights of ChemDiv1_003795
The XLogP value of 5.4091 indicates that ChemDiv1_003795 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_003795. Following Lipinski's Rule of Five, ChemDiv1_003795 has 1 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 ChemDiv1_003795?
The CAS number of ChemDiv1_003795 is 353785-16-7.
What is the molecular formula of ChemDiv1_003795?
The molecular formula of ChemDiv1_003795 is C25H25F3N2O4.
What is the molecular weight of ChemDiv1_003795?
The molecular weight of ChemDiv1_003795 is 474.18 g/mol.
Where can I buy ChemDiv1_003795?
You can request a quote for ChemDiv1_003795 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_003795?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_003795 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.