ChemDiv1_007684
TL;DR: ChemDiv1_007684 (CAS 347310-64-9) is a chemical compound with molecular formula C16H13N3O3S and molecular weight 327.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-methyl-2,1,3-benzothiadiazol-4-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Also Known As: ChemDiv1_007684, BAS 02243036, BIM-0005815.P001, N-(5-methyl-2,1,3-benzothiadiazol-4-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide, AN-465/14963008
| Molecular Formula | C16H13N3O3S |
|---|---|
| Molecular Weight | 327.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.06775 |
| Heavy Atoms | 23 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 347310-64-9 |
|---|---|
| SMILES | CC1=C(C2=NSN=C2C=C1)NC(=O)C3=CC4=C(C=C3)OCCO4 |
| InChIKey | IJIFCXOMQONXIB-UHFFFAOYSA-N |
Product Overview
ChemDiv1_007684 (CAS 347310-64-9), with molecular formula C16H13N3O3S and molecular weight 327.07 g/mol. IUPAC: N-(5-methyl-2,1,3-benzothiadiazol-4-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide.
Chemical Property Profile of ChemDiv1_007684
Property Insights of ChemDiv1_007684
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_007684. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_007684. Following Lipinski's Rule of Five, ChemDiv1_007684 has 1 hydrogen bond donor(s) and 6 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_007684?
The CAS number of ChemDiv1_007684 is 347310-64-9.
What is the molecular formula of ChemDiv1_007684?
The molecular formula of ChemDiv1_007684 is C16H13N3O3S.
What is the molecular weight of ChemDiv1_007684?
The molecular weight of ChemDiv1_007684 is 327.07 g/mol.
Where can I buy ChemDiv1_007684?
You can request a quote for ChemDiv1_007684 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_007684?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_007684 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.