N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide
TL;DR: N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide (CAS 313702-75-9) is a chemical compound with molecular formula C16H17NO3S and molecular weight 303.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide
Also Known As: BAS 00335376, N-Isochroman-1-ylmethyl-benzenesulfonamide, (isochromanylmethyl)(phenylsulfonyl)amine, N-(isochroman-1-ylmethyl)benzenesulfonamide, N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide
| Molecular Formula | C16H17NO3S |
|---|---|
| Molecular Weight | 303.09 g/mol |
| LogP | 2.2789 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.09293 |
| Heavy Atoms | 21 |
| Complexity | 713.31177 |
Chemical Identifiers
| CAS Number | 313702-75-9 |
|---|---|
| SMILES | C1COC(C2=CC=CC=C21)CNS(=O)(=O)C3=CC=CC=C3 |
Product Overview
N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide (CAS 313702-75-9), with molecular formula C16H17NO3S and molecular weight 303.09 g/mol. IUPAC: N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide.
Chemical Property Profile of N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide
Property Insights of N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide
The XLogP value of 2.2789 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide. With a topological polar surface area (TPSA) of 55.4 Ų, N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide has 1 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 N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide?
The CAS number of N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide is 313702-75-9.
What is the molecular formula of N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide?
The molecular formula of N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide is C16H17NO3S.
What is the molecular weight of N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide?
The molecular weight of N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide is 303.09 g/mol.
Where can I buy N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide?
You can request a quote for N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-dihydro-1H-isochromen-1-ylmethyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.