4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate
TL;DR: 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate (CAS 313261-92-6) is a chemical compound with molecular formula C20H22N2O5S and molecular weight 402.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]phenyl] propanoate
Also Known As: 4-(4-(pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate, 4-[4-(pyrrolidine-1-sulfonyl)benzamido]phenyl propanoate, [4-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]phenyl] propanoate, F0012-0204
| Molecular Formula | C20H22N2O5S |
|---|---|
| Molecular Weight | 402.12 g/mol |
| LogP | 3.0388 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.12494 |
| Heavy Atoms | 28 |
| Complexity | 947.0955 |
Chemical Identifiers
| CAS Number | 313261-92-6 |
|---|---|
| SMILES | CCC(=O)OC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3 |
Product Overview
4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate (CAS 313261-92-6), with molecular formula C20H22N2O5S and molecular weight 402.12 g/mol. IUPAC: [4-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]phenyl] propanoate.
Chemical Property Profile of 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate
Property Insights of 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate
The XLogP value of 3.0388 indicates that 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate. Following Lipinski's Rule of Five, 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate 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 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate?
The CAS number of 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate is 313261-92-6.
What is the molecular formula of 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate?
The molecular formula of 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate is C20H22N2O5S.
What is the molecular weight of 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate?
The molecular weight of 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate is 402.12 g/mol.
Where can I buy 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate?
You can request a quote for 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-(Pyrrolidin-1-ylsulfonyl)benzamido)phenyl propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.