![2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one structure](/static/products/370/370072-79-0.png)
2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one
TL;DR: 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one (CAS 370072-79-0) is a chemical compound with molecular formula C17H14ClNO3S and molecular weight 347.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)-12,12-dimethyl-4,11-dioxa-8-thia-6-azatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one, 2-(4-chlorophenyl)-6,6-dimethyl-5,6-dihydropyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4(8H)-one
| Molecular Formula | C17H14ClNO3S |
|---|---|
| Molecular Weight | 347.04 g/mol |
| LogP | 4.4212 |
| Topological Polar Surface Area | 52.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 347.0383 |
| Heavy Atoms | 23 |
| Complexity | 956.3692 |
Chemical Identifiers
| CAS Number | 370072-79-0 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C(=O)OC(=N3)C4=CC=C(C=C4)Cl)C |
Product Overview
2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one (CAS 370072-79-0), with molecular formula C17H14ClNO3S and molecular weight 347.04 g/mol. IUPAC: 5-(4-chlorophenyl)-12,12-dimethyl-4,11-dioxa-8-thia-6-azatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.
Chemical Property Profile of 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one
Property Insights of 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one
The XLogP value of 4.4212 indicates that 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.33 Ų, 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one has 0 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 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one?
The CAS number of 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one is 370072-79-0.
What is the molecular formula of 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one?
The molecular formula of 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one is C17H14ClNO3S.
What is the molecular weight of 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one?
The molecular weight of 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one is 347.04 g/mol.
Where can I buy 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one?
You can request a quote for 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-chlorophenyl)-6,6-dimethyl-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.