BAS 00938676
TL;DR: BAS 00938676 (CAS 313683-87-3) is a chemical compound with molecular formula C22H16Br2N2O2 and molecular weight 497.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-bromo-4-(4-bromobenzoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
Also Known As: BAS 00938676, 7-bromo-4-(4-bromobenzoyl)-5-phenyl-4,5-dihydro-1H-benzo[e][1,4]diazepin-2(3H)-one, 7-bromo-4-(4-bromobenzoyl)-5-phenyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-2-one, F0263-0003, F1596-0010
| Molecular Formula | C22H16Br2N2O2 |
|---|---|
| Molecular Weight | 497.96 g/mol |
| LogP | 5.3955 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 497.95786 |
| Heavy Atoms | 28 |
| Complexity | 1036.1622 |
Chemical Identifiers
| CAS Number | 313683-87-3 |
|---|---|
| SMILES | C1C(=O)NC2=C(C=C(C=C2)Br)C(N1C(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4 |
Product Overview
BAS 00938676 (CAS 313683-87-3), with molecular formula C22H16Br2N2O2 and molecular weight 497.96 g/mol. IUPAC: 7-bromo-4-(4-bromobenzoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one.
Chemical Property Profile of BAS 00938676
Property Insights of BAS 00938676
The XLogP value of 5.3955 indicates that BAS 00938676 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, BAS 00938676 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00938676 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00938676?
The CAS number of BAS 00938676 is 313683-87-3.
What is the molecular formula of BAS 00938676?
The molecular formula of BAS 00938676 is C22H16Br2N2O2.
What is the molecular weight of BAS 00938676?
The molecular weight of BAS 00938676 is 497.96 g/mol.
Where can I buy BAS 00938676?
You can request a quote for BAS 00938676 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00938676?
Yes, KEHONG BIO provides custom synthesis services for BAS 00938676 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.