N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide
TL;DR: N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide (CAS 352657-49-9) is a chemical compound with molecular formula C17H19NO3S and molecular weight 317.11 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)-4-methylbenzenesulfonamide
Also Known As: ChemDiv3_002081, BAS 01505884, IDI1_021047, N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide, AJ-292/12783027
| Molecular Formula | C17H19NO3S |
|---|---|
| Molecular Weight | 317.11 g/mol |
| LogP | 2.58732 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 317.10855 |
| Heavy Atoms | 22 |
| Complexity | 753.72845 |
Chemical Identifiers
| CAS Number | 352657-49-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCC2C3=CC=CC=C3CCO2 |
Product Overview
N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide (CAS 352657-49-9), with molecular formula C17H19NO3S and molecular weight 317.11 g/mol. IUPAC: N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide.
Chemical Property Profile of N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide
Property Insights of N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide
The XLogP value of 2.58732 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide. With a topological polar surface area (TPSA) of 55.4 Ų, N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide 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)-4-methylbenzenesulfonamide?
The CAS number of N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide is 352657-49-9.
What is the molecular formula of N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide?
The molecular formula of N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide is C17H19NO3S.
What is the molecular weight of N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide?
The molecular weight of N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide is 317.11 g/mol.
Where can I buy N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide?
You can request a quote for N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide 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)-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.