Cambridge id 5964201
TL;DR: Cambridge id 5964201 (CAS 298688-13-8) is a chemical compound with molecular formula C25H23N3O2 and molecular weight 397.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(4-methoxyphenyl)-6-pyridin-2-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 01296363, 9-(4-methoxyphenyl)-6-pyridin-2-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one, A2133/0089574, 14-(4-methoxyphenyl)-10-(pyridin-2-yl)-2,9-diazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7-tetraen-12-one, 3-(4-methoxyphenyl)-11-(2-pyridinyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
| Molecular Formula | C25H23N3O2 |
|---|---|
| Molecular Weight | 397.18 g/mol |
| LogP | 5.0697 |
| Topological Polar Surface Area | 63.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 397.17902 |
| Heavy Atoms | 30 |
| Complexity | 1106.7523 |
Chemical Identifiers
| CAS Number | 298688-13-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC=CC=N5)C(=O)C2 |
Product Overview
Cambridge id 5964201 (CAS 298688-13-8), with molecular formula C25H23N3O2 and molecular weight 397.18 g/mol. IUPAC: 9-(4-methoxyphenyl)-6-pyridin-2-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of Cambridge id 5964201
Property Insights of Cambridge id 5964201
The XLogP value of 5.0697 indicates that Cambridge id 5964201 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.25 Ų falls within the moderate polarity range, balancing permeability and solubility for Cambridge id 5964201. Following Lipinski's Rule of Five, Cambridge id 5964201 has 2 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 Cambridge id 5964201?
The CAS number of Cambridge id 5964201 is 298688-13-8.
What is the molecular formula of Cambridge id 5964201?
The molecular formula of Cambridge id 5964201 is C25H23N3O2.
What is the molecular weight of Cambridge id 5964201?
The molecular weight of Cambridge id 5964201 is 397.18 g/mol.
Where can I buy Cambridge id 5964201?
You can request a quote for Cambridge id 5964201 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cambridge id 5964201?
Yes, KEHONG BIO provides custom synthesis services for Cambridge id 5964201 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.