1-(3-Methylpyridin-2-yl)-3-phenylthiourea
TL;DR: 1-(3-Methylpyridin-2-yl)-3-phenylthiourea (CAS 31979-23-4) is a chemical compound with molecular formula C13H13N3S and molecular weight 243.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methyl-2-pyridinyl)-3-phenylthiourea
Also Known As: 1-(3-methylpyridin-2-yl)-3-phenylthiourea, BAS 01513764, N-(3-Methyl-2-pyridyl)-N'-phenylthiourea, 1-Phenyl-3-(3-methyl-2-pyridinyl)thiourea, N-(3-Methyl-2-pyridyl)-N -phenylthiourea
| Molecular Formula | C13H13N3S |
|---|---|
| Molecular Weight | 243.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 69.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.08302 |
| Heavy Atoms | 17 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 31979-23-4 |
|---|---|
| SMILES | CC1=C(N=CC=C1)NC(=S)NC2=CC=CC=C2 |
| InChIKey | KHEJUDWLDAHDQQ-UHFFFAOYSA-N |
Product Overview
1-(3-Methylpyridin-2-yl)-3-phenylthiourea (CAS 31979-23-4), with molecular formula C13H13N3S and molecular weight 243.08 g/mol. IUPAC: 1-(3-methyl-2-pyridinyl)-3-phenylthiourea.
Chemical Property Profile of 1-(3-Methylpyridin-2-yl)-3-phenylthiourea
Property Insights of 1-(3-Methylpyridin-2-yl)-3-phenylthiourea
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Methylpyridin-2-yl)-3-phenylthiourea. The TPSA of 69.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Methylpyridin-2-yl)-3-phenylthiourea. Following Lipinski's Rule of Five, 1-(3-Methylpyridin-2-yl)-3-phenylthiourea has 2 hydrogen bond donor(s) and 2 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 1-(3-Methylpyridin-2-yl)-3-phenylthiourea?
The CAS number of 1-(3-Methylpyridin-2-yl)-3-phenylthiourea is 31979-23-4.
What is the molecular formula of 1-(3-Methylpyridin-2-yl)-3-phenylthiourea?
The molecular formula of 1-(3-Methylpyridin-2-yl)-3-phenylthiourea is C13H13N3S.
What is the molecular weight of 1-(3-Methylpyridin-2-yl)-3-phenylthiourea?
The molecular weight of 1-(3-Methylpyridin-2-yl)-3-phenylthiourea is 243.08 g/mol.
Where can I buy 1-(3-Methylpyridin-2-yl)-3-phenylthiourea?
You can request a quote for 1-(3-Methylpyridin-2-yl)-3-phenylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Methylpyridin-2-yl)-3-phenylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Methylpyridin-2-yl)-3-phenylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.