RefChem:1074392
TL;DR: RefChem:1074392 (CAS 40967-03-1) is a chemical compound with molecular formula C19H19ClN2O4 and molecular weight 374.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-3-(2,3-dihydroxypropoxy)-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one
Also Known As: 5-25-02-00243 (Beilstein Handbook Reference), 1,3-Dihydro-7-chloro-3-(2,3-dihydroxypropoxy)-1-methyl-5-phenyl-2H-1,4-benzodiazepin-2-one, 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(2,3-dihydroxypropoxy)-1-methyl-5-phenyl-, 7-Chloro-1,3-dihydro-3-(2,3-dihydroxypropoxy)-1-methyl-5-phenyl-2H-1,4-benzodiazepin-2-one, 7-Chloro-3-(2,3-dihydroxypropoxy)-1-methyl-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one
| Molecular Formula | C19H19ClN2O4 |
|---|---|
| Molecular Weight | 374.10 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 82.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 374.10333 |
| Heavy Atoms | 26 |
| Complexity | 524.0 |
Chemical Identifiers
| CAS Number | 40967-03-1 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)OCC(CO)O)C3=CC=CC=C3 |
| InChIKey | UINFKULKHSCUPP-UHFFFAOYSA-N |
Product Overview
RefChem:1074392 (CAS 40967-03-1), with molecular formula C19H19ClN2O4 and molecular weight 374.10 g/mol. IUPAC: 7-chloro-3-(2,3-dihydroxypropoxy)-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one.
Chemical Property Profile of RefChem:1074392
Property Insights of RefChem:1074392
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1074392. The TPSA of 82.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1074392. Following Lipinski's Rule of Five, RefChem:1074392 has 2 hydrogen bond donor(s) and 5 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:1074392?
The CAS number of RefChem:1074392 is 40967-03-1.
What is the molecular formula of RefChem:1074392?
The molecular formula of RefChem:1074392 is C19H19ClN2O4.
What is the molecular weight of RefChem:1074392?
The molecular weight of RefChem:1074392 is 374.10 g/mol.
Where can I buy RefChem:1074392?
You can request a quote for RefChem:1074392 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1074392?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1074392 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.