BIM-0045113.P001
TL;DR: BIM-0045113.P001 (CAS 6090-48-8) is a chemical compound with molecular formula C24H22N2OS and molecular weight 386.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-9-phenyl-6-thiophen-2-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: BIM-0045113.P001, 3-methyl-9-phenyl-6-thiophen-2-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one, 8-methyl-3-phenyl-11-(2-thienyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 8-Methyl-3-phenyl-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
| Molecular Formula | C24H22N2OS |
|---|---|
| Molecular Weight | 386.15 g/mol |
| LogP | 6.03602 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 386.1453 |
| Heavy Atoms | 28 |
| Complexity | 1053.4739 |
Chemical Identifiers
| CAS Number | 6090-48-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC3=C(C(N2)C4=CC=CS4)C(=O)CC(C3)C5=CC=CC=C5 |
Product Overview
BIM-0045113.P001 (CAS 6090-48-8), with molecular formula C24H22N2OS and molecular weight 386.15 g/mol. IUPAC: 3-methyl-9-phenyl-6-thiophen-2-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BIM-0045113.P001
Property Insights of BIM-0045113.P001
The XLogP value of 6.03602 indicates that BIM-0045113.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, BIM-0045113.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0045113.P001 has 2 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 BIM-0045113.P001?
The CAS number of BIM-0045113.P001 is 6090-48-8.
What is the molecular formula of BIM-0045113.P001?
The molecular formula of BIM-0045113.P001 is C24H22N2OS.
What is the molecular weight of BIM-0045113.P001?
The molecular weight of BIM-0045113.P001 is 386.15 g/mol.
Where can I buy BIM-0045113.P001?
You can request a quote for BIM-0045113.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0045113.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0045113.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.