F0018-0645
TL;DR: F0018-0645 (CAS 312606-58-9) is a chemical compound with molecular formula C23H19N3O4 and molecular weight 401.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-4-(4-nitrobenzoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
Also Known As: F0018-0645, F1596-0071, 7-methyl-4-(4-nitrobenzoyl)-5-phenyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-2-one, 7-methyl-4-(4-nitrobenzoyl)-5-phenyl-4,5-dihydro-1H-benzo[e][1,4]diazepin-2(3H)-one, 7-methyl-4-(4-nitrobenzoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
| Molecular Formula | C23H19N3O4 |
|---|---|
| Molecular Weight | 401.14 g/mol |
| LogP | 4.08712 |
| Topological Polar Surface Area | 92.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 401.13754 |
| Heavy Atoms | 30 |
| Complexity | 1126.945 |
Chemical Identifiers
| CAS Number | 312606-58-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(=O)CN(C2C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
F0018-0645 (CAS 312606-58-9), with molecular formula C23H19N3O4 and molecular weight 401.14 g/mol. IUPAC: 7-methyl-4-(4-nitrobenzoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one.
Chemical Property Profile of F0018-0645
Property Insights of F0018-0645
The XLogP value of 4.08712 indicates that F0018-0645 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.55 Ų falls within the moderate polarity range, balancing permeability and solubility for F0018-0645. Following Lipinski's Rule of Five, F0018-0645 has 1 hydrogen bond donor(s) and 4 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 F0018-0645?
The CAS number of F0018-0645 is 312606-58-9.
What is the molecular formula of F0018-0645?
The molecular formula of F0018-0645 is C23H19N3O4.
What is the molecular weight of F0018-0645?
The molecular weight of F0018-0645 is 401.14 g/mol.
Where can I buy F0018-0645?
You can request a quote for F0018-0645 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0018-0645?
Yes, KEHONG BIO provides custom synthesis services for F0018-0645 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.