BAS 13120393
TL;DR: BAS 13120393 (CAS 674808-13-0) is a chemical compound with molecular formula C28H24Cl2N2O2 and molecular weight 490.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-chlorophenyl)-9-(4-chlorophenyl)-5-propanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 13120393, 1-[11-(3-chlorophenyl)-3-(4-chlorophenyl)-1-hydroxy-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]propan-1-one, 1-(11-(3-chlorophenyl)-3-(4-chlorophenyl)-1-hydroxy-3,4-dihydro-2H-dibenzo[b,e][1,4]diazepin-10(11H)-yl)propan-1-one, 1-[11-(3-chlorophenyl)-3-(4-chlorophenyl)-1-hydroxy-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-1-propanone, 11-(3-chlorophenyl)-3-(4-chlorophenyl)-10-propanoyl-2,3,4-trihydro-5H,11H-benz o[b]benzo[2,1-f]1,4-diazepin-1-one
| Molecular Formula | C28H24Cl2N2O2 |
|---|---|
| Molecular Weight | 490.12 g/mol |
| LogP | 7.304 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 490.1215 |
| Heavy Atoms | 34 |
| Complexity | 1299.7681 |
Chemical Identifiers
| CAS Number | 674808-13-0 |
|---|---|
| SMILES | CCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)Cl)NC4=CC=CC=C41)C5=CC(=CC=C5)Cl |
Product Overview
BAS 13120393 (CAS 674808-13-0), with molecular formula C28H24Cl2N2O2 and molecular weight 490.12 g/mol. IUPAC: 6-(3-chlorophenyl)-9-(4-chlorophenyl)-5-propanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 13120393
Property Insights of BAS 13120393
The XLogP value of 7.304 indicates that BAS 13120393 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, BAS 13120393 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 13120393 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 13120393?
The CAS number of BAS 13120393 is 674808-13-0.
What is the molecular formula of BAS 13120393?
The molecular formula of BAS 13120393 is C28H24Cl2N2O2.
What is the molecular weight of BAS 13120393?
The molecular weight of BAS 13120393 is 490.12 g/mol.
Where can I buy BAS 13120393?
You can request a quote for BAS 13120393 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13120393?
Yes, KEHONG BIO provides custom synthesis services for BAS 13120393 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.