AB00674706-01
TL;DR: AB00674706-01 (CAS 312606-52-3) is a chemical compound with molecular formula C23H19BrN2O2 and molecular weight 434.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-bromobenzoyl)-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
Also Known As: AB00674706-01, 4-(2-bromobenzoyl)-7-methyl-5-phenyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-2-one, F1596-0202, 4-(2-bromobenzoyl)-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one, 4-(2-bromobenzoyl)-7-methyl-5-phenyl-4,5-dihydro-1H-benzo[e][1,4]diazepin-2(3H)-one
| Molecular Formula | C23H19BrN2O2 |
|---|---|
| Molecular Weight | 434.06 g/mol |
| LogP | 4.94142 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 434.063 |
| Heavy Atoms | 28 |
| Complexity | 1049.4778 |
Chemical Identifiers
| CAS Number | 312606-52-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(=O)CN(C2C3=CC=CC=C3)C(=O)C4=CC=CC=C4Br |
Product Overview
AB00674706-01 (CAS 312606-52-3), with molecular formula C23H19BrN2O2 and molecular weight 434.06 g/mol. IUPAC: 4-(2-bromobenzoyl)-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one.
Chemical Property Profile of AB00674706-01
Property Insights of AB00674706-01
The XLogP value of 4.94142 indicates that AB00674706-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, AB00674706-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00674706-01 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00674706-01?
The CAS number of AB00674706-01 is 312606-52-3.
What is the molecular formula of AB00674706-01?
The molecular formula of AB00674706-01 is C23H19BrN2O2.
What is the molecular weight of AB00674706-01?
The molecular weight of AB00674706-01 is 434.06 g/mol.
Where can I buy AB00674706-01?
You can request a quote for AB00674706-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00674706-01?
Yes, KEHONG BIO provides custom synthesis services for AB00674706-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.