1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin
TL;DR: 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin (CAS 75017-39-9) is a chemical compound with molecular formula C18H16Cl2N2O and molecular weight 346.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-chloro-7-(2-chlorophenyl)-2,4,4a,5-tetrahydro-1H-[1,4]oxazino[4,3-a][1,4]benzodiazepine
Also Known As: 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin, 1,2,4a,5-Tetrahydro-9-chloro-7-(2-chlorophenyl)-4H-(1,4)oxazino(4,3-a)(1,4)benzodiazepine, 4H-(1,4)Oxazino(4,3-a)(1,4)benzodiazepine, 1,2,4a,5-tetrahydro-9-chloro-7-(2-chlorophenyl)-, 9-Chloro-7-(2-chlorophenyl)-1,2,4a,5-tetrahydro-4H-[1,4]oxazino[4,3-a][1,4]benzodiazepine, 9-chloro-7-(2-chlorophenyl)-2,4,4a,5-tetrahydro-1H-[1,4]oxazino[4,3-a][1,4]benzodiazepine
| Molecular Formula | C18H16Cl2N2O |
|---|---|
| Molecular Weight | 346.06 g/mol |
| LogP | 4.0496 |
| Topological Polar Surface Area | 24.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 346.06396 |
| Heavy Atoms | 23 |
| Complexity | 775.36694 |
Chemical Identifiers
| CAS Number | 75017-39-9 |
|---|---|
| SMILES | C1COCC2N1C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4Cl |
Product Overview
1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin (CAS 75017-39-9), with molecular formula C18H16Cl2N2O and molecular weight 346.06 g/mol. IUPAC: 9-chloro-7-(2-chlorophenyl)-2,4,4a,5-tetrahydro-1H-[1,4]oxazino[4,3-a][1,4]benzodiazepine.
Chemical Property Profile of 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin
Property Insights of 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin
The XLogP value of 4.0496 indicates that 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.83 Ų, 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin has 0 hydrogen bond donor(s) and 3 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 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin?
The CAS number of 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin is 75017-39-9.
What is the molecular formula of 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin?
The molecular formula of 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin is C18H16Cl2N2O.
What is the molecular weight of 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin?
The molecular weight of 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin is 346.06 g/mol.
Where can I buy 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin?
You can request a quote for 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4,4a-Tetrahydro-9-chlor-5-(2'-chlorphenyl)-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.