ChemDiv1_001752
TL;DR: ChemDiv1_001752 (CAS 329218-95-3) is a chemical compound with molecular formula C15H13NO3S and molecular weight 287.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(furan-2-yl)-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]oxazin-4-one
Also Known As: ChemDiv1_001752, BIM-0025533.P001, 2-(furan-2-yl)-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]oxazin-4-one, 2-(furan-2-yl)-7-methyl-5,6,7,8-tetrahydro-4H-[1]benzothieno[2,3-d][1,3]oxazin-4-one, 2-(2-furyl)-7-methyl-5,6,7,8-tetrahydrobenzo[b]thiopheno[2,3-d]1,3-oxazin-4-on e
| Molecular Formula | C15H13NO3S |
|---|---|
| Molecular Weight | 287.06 g/mol |
| LogP | 3.6343 |
| Topological Polar Surface Area | 56.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 287.0616 |
| Heavy Atoms | 20 |
| Complexity | 828.79114 |
Chemical Identifiers
| CAS Number | 329218-95-3 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=C2C(=O)OC(=N3)C4=CC=CO4 |
Product Overview
ChemDiv1_001752 (CAS 329218-95-3), with molecular formula C15H13NO3S and molecular weight 287.06 g/mol. IUPAC: 2-(furan-2-yl)-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]oxazin-4-one.
Chemical Property Profile of ChemDiv1_001752
Property Insights of ChemDiv1_001752
The XLogP value of 3.6343 indicates that ChemDiv1_001752 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.24 Ų, ChemDiv1_001752 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_001752 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 ChemDiv1_001752?
The CAS number of ChemDiv1_001752 is 329218-95-3.
What is the molecular formula of ChemDiv1_001752?
The molecular formula of ChemDiv1_001752 is C15H13NO3S.
What is the molecular weight of ChemDiv1_001752?
The molecular weight of ChemDiv1_001752 is 287.06 g/mol.
Where can I buy ChemDiv1_001752?
You can request a quote for ChemDiv1_001752 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_001752?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_001752 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.