Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)-
TL;DR: Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)- (CAS 181305-52-2) is a chemical compound with molecular formula C14H15N5S and molecular weight 285.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-cyano-2-pyridinyl)-3-[2-(1-methylpyrrol-2-yl)ethyl]thiourea
Also Known As: PETT deriv., LY300046HCl Analog 33, N4-allyl-6-chloro-pyrimidine-4,5-diamine, Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)-, N-(2-(1-Methylpyrrolyl)ethyl)-N'-(2-(5-cyanopyridyl))thiourea
| Molecular Formula | C14H15N5S |
|---|---|
| Molecular Weight | 285.10 g/mol |
| LogP | 1.82088 |
| Topological Polar Surface Area | 65.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.10483 |
| Heavy Atoms | 20 |
| Complexity | 623.759 |
Chemical Identifiers
| CAS Number | 181305-52-2 |
|---|---|
| SMILES | CN1C=CC=C1CCNC(=S)NC2=NC=C(C=C2)C#N |
Product Overview
Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)- (CAS 181305-52-2), with molecular formula C14H15N5S and molecular weight 285.10 g/mol. IUPAC: 1-(5-cyano-2-pyridinyl)-3-[2-(1-methylpyrrol-2-yl)ethyl]thiourea.
Chemical Property Profile of Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)-
Property Insights of Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)-
The XLogP value of 1.82088 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)-. The TPSA of 65.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)-. Following Lipinski's Rule of Five, Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)- has 2 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 Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)-?
The CAS number of Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)- is 181305-52-2.
What is the molecular formula of Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)-?
The molecular formula of Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)- is C14H15N5S.
What is the molecular weight of Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)-?
The molecular weight of Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)- is 285.10 g/mol.
Where can I buy Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)-?
You can request a quote for Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.