BAS 01296193
TL;DR: BAS 01296193 (CAS 5979-81-7) is a chemical compound with molecular formula C26H23FN2O2 and molecular weight 414.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-fluorophenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 01296193, BIM-0013650.P001, 6-(3-fluorophenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one, 11-(3-fluorophenyl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, A2088/0087827
| Molecular Formula | C26H23FN2O2 |
|---|---|
| Molecular Weight | 414.17 g/mol |
| LogP | 5.8138 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 414.17435 |
| Heavy Atoms | 31 |
| Complexity | 1170.0343 |
Chemical Identifiers
| CAS Number | 5979-81-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC(=CC=C5)F)C(=O)C2 |
Product Overview
BAS 01296193 (CAS 5979-81-7), with molecular formula C26H23FN2O2 and molecular weight 414.17 g/mol. IUPAC: 6-(3-fluorophenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 01296193
Property Insights of BAS 01296193
The XLogP value of 5.8138 indicates that BAS 01296193 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, BAS 01296193 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01296193 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 BAS 01296193?
The CAS number of BAS 01296193 is 5979-81-7.
What is the molecular formula of BAS 01296193?
The molecular formula of BAS 01296193 is C26H23FN2O2.
What is the molecular weight of BAS 01296193?
The molecular weight of BAS 01296193 is 414.17 g/mol.
Where can I buy BAS 01296193?
You can request a quote for BAS 01296193 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01296193?
Yes, KEHONG BIO provides custom synthesis services for BAS 01296193 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.