2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile
TL;DR: 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile (CAS 60311-24-2) is a chemical compound with molecular formula C8H10N2OS2 and molecular weight 214.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile
Also Known As: 2-(pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile, 2-(pyrrolidine-1-carbonyl)-3,3-bis-sulfanyl-prop-2-enenitrile
| Molecular Formula | C8H10N2OS2 |
|---|---|
| Molecular Weight | 214.02 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 46.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 214.02345 |
| Heavy Atoms | 13 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 60311-24-2 |
|---|---|
| SMILES | C1CCN(C1)C(=O)C(=C(S)S)C#N |
| InChIKey | XKSDIFMRAUBAEQ-UHFFFAOYSA-N |
Product Overview
2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile (CAS 60311-24-2), with molecular formula C8H10N2OS2 and molecular weight 214.02 g/mol. IUPAC: 2-(pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile.
Chemical Property Profile of 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile
Property Insights of 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile. With a topological polar surface area (TPSA) of 46.1 Ų, 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile has 2 hydrogen bond donor(s) and 4 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 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile?
The CAS number of 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile is 60311-24-2.
What is the molecular formula of 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile?
The molecular formula of 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile is C8H10N2OS2.
What is the molecular weight of 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile?
The molecular weight of 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile is 214.02 g/mol.
Where can I buy 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile?
You can request a quote for 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Pyrrolidine-1-carbonyl)-3,3-bis(sulfanyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.