1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea
TL;DR: 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea (CAS 99616-27-0) is a chemical compound with molecular formula C9H14N4S and molecular weight 210.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dimethyl-3-(pyridin-2-ylmethylamino)thiourea
Also Known As: 1,1-dimethyl-3-(pyridin-2-ylmethylamino)thiourea, 1-(2-Pyridinylmethyl)-4,4-dimethylthiosemicarbazide, 3,3-dimethyl-1-{[(pyridin-2-yl)methyl]amino}thiourea, N,N-Dimethyl-2-[(pyridin-2-yl)methyl]hydrazine-1-carbothioamide
| Molecular Formula | C9H14N4S |
|---|---|
| Molecular Weight | 210.09 g/mol |
| LogP | 0.5223 |
| Topological Polar Surface Area | 40.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 210.09392 |
| Heavy Atoms | 14 |
| Complexity | 286.12326 |
Chemical Identifiers
| CAS Number | 99616-27-0 |
|---|---|
| SMILES | CN(C)C(=S)NNCC1=CC=CC=N1 |
Product Overview
1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea (CAS 99616-27-0), with molecular formula C9H14N4S and molecular weight 210.09 g/mol. IUPAC: 1,1-dimethyl-3-(pyridin-2-ylmethylamino)thiourea.
Chemical Property Profile of 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea
Property Insights of 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea
The XLogP value of 0.5223 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea. With a topological polar surface area (TPSA) of 40.19 Ų, 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea 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 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea?
The CAS number of 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea is 99616-27-0.
What is the molecular formula of 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea?
The molecular formula of 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea is C9H14N4S.
What is the molecular weight of 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea?
The molecular weight of 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea is 210.09 g/mol.
Where can I buy 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea?
You can request a quote for 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.