Sulfonamidopyrrolidinone 3a
TL;DR: Sulfonamidopyrrolidinone 3a (CAS 186547-01-3) is a chemical compound with molecular formula C23H24N4O4S and molecular weight 452.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[(3S)-3-[(7-methoxynaphthalen-2-yl)sulfonylamino]-2-oxopyrrolidin-1-yl]methyl]benzenecarboximidamide
Also Known As: Sulfonamidopyrrolidinone 3a, J1.175.137G, Benzenecarboximidamide,3-[[(3S)-3-[[(7-methoxy-2-naphthalenyl)sulfonyl]amino]-2-oxo-1-pyrrolidinyl]methyl]-, Benzenecarboximidamide, 3-[[(3S)-3-[[(7-methoxy-2-naphthalenyl)sulfonyl]amino]-2-oxo-1-pyrrolidinyl]methyl]-, 3-[[(3S)-2-Oxo-3beta-(7-methoxy-2-naphthylsulfonylamino)pyrrolizino]methyl]benzamidine
| Molecular Formula | C23H24N4O4S |
|---|---|
| Molecular Weight | 452.15 g/mol |
| LogP | 2.21187 |
| Topological Polar Surface Area | 125.58 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.15182 |
| Heavy Atoms | 32 |
| Complexity | 1306.3491 |
Chemical Identifiers
| CAS Number | 186547-01-3 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)N[C@H]3CCN(C3=O)CC4=CC(=CC=C4)C(=N)N |
Product Overview
Sulfonamidopyrrolidinone 3a (CAS 186547-01-3), with molecular formula C23H24N4O4S and molecular weight 452.15 g/mol. IUPAC: 3-[[(3S)-3-[(7-methoxynaphthalen-2-yl)sulfonylamino]-2-oxopyrrolidin-1-yl]methyl]benzenecarboximidamide.
Chemical Property Profile of Sulfonamidopyrrolidinone 3a
Property Insights of Sulfonamidopyrrolidinone 3a
The XLogP value of 2.21187 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sulfonamidopyrrolidinone 3a. The TPSA of 125.58 Ų falls within the moderate polarity range, balancing permeability and solubility for Sulfonamidopyrrolidinone 3a. Following Lipinski's Rule of Five, Sulfonamidopyrrolidinone 3a has 3 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 Sulfonamidopyrrolidinone 3a?
The CAS number of Sulfonamidopyrrolidinone 3a is 186547-01-3.
What is the molecular formula of Sulfonamidopyrrolidinone 3a?
The molecular formula of Sulfonamidopyrrolidinone 3a is C23H24N4O4S.
What is the molecular weight of Sulfonamidopyrrolidinone 3a?
The molecular weight of Sulfonamidopyrrolidinone 3a is 452.15 g/mol.
Where can I buy Sulfonamidopyrrolidinone 3a?
You can request a quote for Sulfonamidopyrrolidinone 3a directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfonamidopyrrolidinone 3a?
Yes, KEHONG BIO provides custom synthesis services for Sulfonamidopyrrolidinone 3a and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.