2-氯-5-(甲硫基)-4,6-嘧啶二胺
TL;DR: 2-氯-5-(甲硫基)-4,6-嘧啶二胺 (CAS 70958-50-8) is a chemical compound with molecular formula C5H7ClN4S and molecular weight 190.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氯-5-(甲硫基)-4,6-嘧啶二胺
2-chloro-5-methylsulfanylpyrimidine-4,6-diamine
Also Known As: 2-CHLORO-5-(METHYLTHIO)-4,6-PYRIMIDINEDIAMINE, 2-chloro-5-methylsulfanylpyrimidine-4,6-diamine, 2-chloro-5-(methylsulfanyl)pyrimidine-4,6-diamine, J1.589.970K
| Molecular Formula | C5H7ClN4S |
|---|---|
| Molecular Weight | 190.01 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.008 |
| Heavy Atoms | 11 |
| Complexity | 124.0 |
Chemical Identifiers
| CAS Number | 70958-50-8 |
|---|---|
| SMILES | CSC1=C(N=C(N=C1N)Cl)N |
| InChIKey | GLRCVPBAAAKKHB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氯-5-(甲硫基)-4,6-嘧啶二胺 (CAS 70958-50-8), with molecular formula C5H7ClN4S and molecular weight 190.01 g/mol. IUPAC: 2-chloro-5-methylsulfanylpyrimidine-4,6-diamine.
Chemical Property Profile of 2-氯-5-(甲硫基)-4,6-嘧啶二胺
Property Insights of 2-氯-5-(甲硫基)-4,6-嘧啶二胺
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氯-5-(甲硫基)-4,6-嘧啶二胺. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-氯-5-(甲硫基)-4,6-嘧啶二胺. Following Lipinski's Rule of Five, 2-氯-5-(甲硫基)-4,6-嘧啶二胺 has 2 hydrogen bond donor(s) and 5 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-氯-5-(甲硫基)-4,6-嘧啶二胺?
The CAS number of 2-氯-5-(甲硫基)-4,6-嘧啶二胺 is 70958-50-8.
What is the molecular formula of 2-氯-5-(甲硫基)-4,6-嘧啶二胺?
The molecular formula of 2-氯-5-(甲硫基)-4,6-嘧啶二胺 is C5H7ClN4S.
What is the molecular weight of 2-氯-5-(甲硫基)-4,6-嘧啶二胺?
The molecular weight of 2-氯-5-(甲硫基)-4,6-嘧啶二胺 is 190.01 g/mol.
Where can I buy 2-氯-5-(甲硫基)-4,6-嘧啶二胺?
You can request a quote for 2-氯-5-(甲硫基)-4,6-嘧啶二胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氯-5-(甲硫基)-4,6-嘧啶二胺?
Yes, KEHONG BIO provides custom synthesis services for 2-氯-5-(甲硫基)-4,6-嘧啶二胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.