1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea
TL;DR: 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea (CAS 66713-58-4) is a chemical compound with molecular formula C10H13N3S and molecular weight 207.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methyl-2-pyridinyl)-3-prop-2-enylthiourea
Also Known As: n-Butyl trimethylsilylethynyl ketone, 1-(3-methylpyridin-2-yl)-3-prop-2-enylthiourea, 1-(3-methylpyridin-2-yl)-3-prop-2-enyl-thiourea, Thiourea, N-(3-methyl-2-pyridinyl)-N'-2-propenyl-, N-(3-Methylpyridin-2-yl)-N'-(prop-2-en-1-yl)thiourea
| Molecular Formula | C10H13N3S |
|---|---|
| Molecular Weight | 207.08 g/mol |
| LogP | 1.86242 |
| Topological Polar Surface Area | 36.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.08302 |
| Heavy Atoms | 14 |
| Complexity | 335.89392 |
Chemical Identifiers
| CAS Number | 66713-58-4 |
|---|---|
| SMILES | CC1=C(N=CC=C1)NC(=S)NCC=C |
Product Overview
1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea (CAS 66713-58-4), with molecular formula C10H13N3S and molecular weight 207.08 g/mol. IUPAC: 1-(3-methyl-2-pyridinyl)-3-prop-2-enylthiourea.
Chemical Property Profile of 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea
Property Insights of 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea
The XLogP value of 1.86242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea. With a topological polar surface area (TPSA) of 36.95 Ų, 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea 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-Methyl-2-pyridinyl)-3-prop-2-enylthiourea?
The CAS number of 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea is 66713-58-4.
What is the molecular formula of 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea?
The molecular formula of 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea is C10H13N3S.
What is the molecular weight of 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea?
The molecular weight of 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea is 207.08 g/mol.
Where can I buy 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea?
You can request a quote for 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Methyl-2-pyridinyl)-3-prop-2-enylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.