RefChem:378168
TL;DR: RefChem:378168 (CAS 28748-73-4) is a chemical compound with molecular formula C17H15ClN2O and molecular weight 298.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-12-phenyl-1,9-diazatricyclo[6.4.1.04,13]trideca-4(13),5,7-trien-10-one
Also Known As: 5-24-04-00450 (Beilstein Handbook Reference), 3,4,6,7-Tetrahydro-9-chloro-4-phenylpyrrolo(1,2,3-ef)(1,5)benzodiazepin-2(1H)-one, 9-Chloro-1,2,4,5-tetrahydro-4-phenylpyrrolo(1,2,3-ef)(1,5)benzodiazepin-6(7H)-one, Pyrrolo(1,2,3-ef)(1,5)benzodiazepin-2(1H)-one, 3,4,6,7-tetrahydro-9-chloro-4-phenyl-, 9-Chloro-4-phenyl-3,4,6,7-tetrahydro[1,4]diazepino[3,2,1-hi]indol-2-ol
| Molecular Formula | C17H15ClN2O |
|---|---|
| Molecular Weight | 298.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 298.08728 |
| Heavy Atoms | 21 |
| Complexity | 410.0 |
Chemical Identifiers
| CAS Number | 28748-73-4 |
|---|---|
| SMILES | C1CN2C(CC(=O)NC3=CC(=CC1=C32)Cl)C4=CC=CC=C4 |
| InChIKey | ZLKKDGWBBURRCK-UHFFFAOYSA-N |
Product Overview
RefChem:378168 (CAS 28748-73-4), with molecular formula C17H15ClN2O and molecular weight 298.09 g/mol. IUPAC: 6-chloro-12-phenyl-1,9-diazatricyclo[6.4.1.04,13]trideca-4(13),5,7-trien-10-one.
Chemical Property Profile of RefChem:378168
Property Insights of RefChem:378168
The XLogP value of 3.1 indicates that RefChem:378168 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, RefChem:378168 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:378168 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 RefChem:378168?
The CAS number of RefChem:378168 is 28748-73-4.
What is the molecular formula of RefChem:378168?
The molecular formula of RefChem:378168 is C17H15ClN2O.
What is the molecular weight of RefChem:378168?
The molecular weight of RefChem:378168 is 298.09 g/mol.
Where can I buy RefChem:378168?
You can request a quote for RefChem:378168 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:378168?
Yes, KEHONG BIO provides custom synthesis services for RefChem:378168 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.