C15H16N2O5S
TL;DR: C15H16N2O5S (CAS 1007952-40-0) is a chemical compound with molecular formula C15H16N2O5S and molecular weight 336.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Also Known As: ASN 12738160, 2-((3,5-Dimethylisoxazol-4-yl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid, 2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid, 2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid, 2-((3,5-Dimethylisoxazol-4-yl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylicacid
| Molecular Formula | C15H16N2O5S |
|---|---|
| Molecular Weight | 336.08 g/mol |
| LogP | 1.49164 |
| Topological Polar Surface Area | 100.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 336.078 |
| Heavy Atoms | 23 |
| Complexity | 852.24243 |
Chemical Identifiers
| CAS Number | 1007952-40-0 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)O |
Product Overview
C15H16N2O5S (CAS 1007952-40-0), with molecular formula C15H16N2O5S and molecular weight 336.08 g/mol. IUPAC: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid.
Chemical Property Profile of C15H16N2O5S
Property Insights of C15H16N2O5S
The XLogP value of 1.49164 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C15H16N2O5S. The TPSA of 100.71 Ų falls within the moderate polarity range, balancing permeability and solubility for C15H16N2O5S. Following Lipinski's Rule of Five, C15H16N2O5S has 1 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 C15H16N2O5S?
The CAS number of C15H16N2O5S is 1007952-40-0.
What is the molecular formula of C15H16N2O5S?
The molecular formula of C15H16N2O5S is C15H16N2O5S.
What is the molecular weight of C15H16N2O5S?
The molecular weight of C15H16N2O5S is 336.08 g/mol.
Where can I buy C15H16N2O5S?
You can request a quote for C15H16N2O5S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C15H16N2O5S?
Yes, KEHONG BIO provides custom synthesis services for C15H16N2O5S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.