BIM-0042676.P001
TL;DR: BIM-0042676.P001 (CAS 6049-86-1) is a chemical compound with molecular formula C29H30N2O2 and molecular weight 438.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(4-methoxyphenyl)-6-(4-propan-2-ylphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: BIM-0042676.P001, 3-(4-methoxyphenyl)-11-[4-(propan-2-yl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 9-(4-methoxyphenyl)-6-(4-propan-2-ylphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one, 11-(4-isopropylphenyl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 10-(4-ISOPROPYLPHENYL)-14-(4-METHOXYPHENYL)-2,9-DIAZATRICYCLO[9.4.0.0(3),?]PENTADECA-1(11),3,5,7-TETRAEN-12-ONE
| Molecular Formula | C29H30N2O2 |
|---|---|
| Molecular Weight | 438.23 g/mol |
| LogP | 6.7981 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.23074 |
| Heavy Atoms | 33 |
| Complexity | 1193.0514 |
Chemical Identifiers
| CAS Number | 6049-86-1 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)OC)NC5=CC=CC=C5N2 |
Product Overview
BIM-0042676.P001 (CAS 6049-86-1), with molecular formula C29H30N2O2 and molecular weight 438.23 g/mol. IUPAC: 9-(4-methoxyphenyl)-6-(4-propan-2-ylphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BIM-0042676.P001
Property Insights of BIM-0042676.P001
The XLogP value of 6.7981 indicates that BIM-0042676.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, BIM-0042676.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0042676.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-0042676.P001?
The CAS number of BIM-0042676.P001 is 6049-86-1.
What is the molecular formula of BIM-0042676.P001?
The molecular formula of BIM-0042676.P001 is C29H30N2O2.
What is the molecular weight of BIM-0042676.P001?
The molecular weight of BIM-0042676.P001 is 438.23 g/mol.
Where can I buy BIM-0042676.P001?
You can request a quote for BIM-0042676.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0042676.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0042676.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.