C25H29N3O6S
TL;DR: C25H29N3O6S (CAS 1173674-82-2) is a chemical compound with molecular formula C25H29N3O6S and molecular weight 499.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-(1,3-benzodioxol-5-yl)-1-[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]pyrrolidine-2-carboxamide
Also Known As: (S)-N-(benzo[d][1,3]dioxol-5-yl)-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide, N-1,3-benzodioxol-5-yl-1-({1-[(4-methylphenyl)sulfonyl]piperidin-4-yl}carbonyl)-L-prolinamide
| Molecular Formula | C25H29N3O6S |
|---|---|
| Molecular Weight | 499.18 g/mol |
| LogP | 2.75412 |
| Topological Polar Surface Area | 105.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 499.1777 |
| Heavy Atoms | 35 |
| Complexity | 1222.2633 |
Chemical Identifiers
| CAS Number | 1173674-82-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC[C@H]3C(=O)NC4=CC5=C(C=C4)OCO5 |
Product Overview
C25H29N3O6S (CAS 1173674-82-2), with molecular formula C25H29N3O6S and molecular weight 499.18 g/mol. IUPAC: (2S)-N-(1,3-benzodioxol-5-yl)-1-[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]pyrrolidine-2-carboxamide.
Chemical Property Profile of C25H29N3O6S
Property Insights of C25H29N3O6S
The XLogP value of 2.75412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C25H29N3O6S. The TPSA of 105.25 Ų falls within the moderate polarity range, balancing permeability and solubility for C25H29N3O6S. Following Lipinski's Rule of Five, C25H29N3O6S 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 C25H29N3O6S?
The CAS number of C25H29N3O6S is 1173674-82-2.
What is the molecular formula of C25H29N3O6S?
The molecular formula of C25H29N3O6S is C25H29N3O6S.
What is the molecular weight of C25H29N3O6S?
The molecular weight of C25H29N3O6S is 499.18 g/mol.
Where can I buy C25H29N3O6S?
You can request a quote for C25H29N3O6S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C25H29N3O6S?
Yes, KEHONG BIO provides custom synthesis services for C25H29N3O6S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.