BAS 13120380
TL;DR: BAS 13120380 (CAS 675150-74-0) is a chemical compound with molecular formula C29H27ClN2O3 and molecular weight 486.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(4-chlorophenyl)-6-(4-methoxyphenyl)-5-propanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 13120380, 1-[3-(4-chlorophenyl)-1-hydroxy-11-(4-methoxyphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]propan-1-one, 1-(3-(4-chlorophenyl)-1-hydroxy-11-(4-methoxyphenyl)-3,4-dihydro-2H-dibenzo[b,e][1,4]diazepin-10(11H)-yl)propan-1-one, 1-[3-(4-chlorophenyl)-1-hydroxy-11-(4-methoxyphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-1-propanone, 3-(4-chlorophenyl)-11-(4-methoxyphenyl)-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
| Molecular Formula | C29H27ClN2O3 |
|---|---|
| Molecular Weight | 486.17 g/mol |
| LogP | 6.6592 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 486.17102 |
| Heavy Atoms | 35 |
| Complexity | 1298.262 |
Chemical Identifiers
| CAS Number | 675150-74-0 |
|---|---|
| SMILES | CCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)Cl)NC4=CC=CC=C41)C5=CC=C(C=C5)OC |
Product Overview
BAS 13120380 (CAS 675150-74-0), with molecular formula C29H27ClN2O3 and molecular weight 486.17 g/mol. IUPAC: 9-(4-chlorophenyl)-6-(4-methoxyphenyl)-5-propanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 13120380
Property Insights of BAS 13120380
The XLogP value of 6.6592 indicates that BAS 13120380 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, BAS 13120380 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 13120380 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 BAS 13120380?
The CAS number of BAS 13120380 is 675150-74-0.
What is the molecular formula of BAS 13120380?
The molecular formula of BAS 13120380 is C29H27ClN2O3.
What is the molecular weight of BAS 13120380?
The molecular weight of BAS 13120380 is 486.17 g/mol.
Where can I buy BAS 13120380?
You can request a quote for BAS 13120380 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13120380?
Yes, KEHONG BIO provides custom synthesis services for BAS 13120380 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.