6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine
TL;DR: 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine (CAS 87141-85-3) is a chemical compound with molecular formula C8H10ClN3 and molecular weight 183.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-methyl-5-prop-2-enylpyrimidin-4-amine
Also Known As: 5-allyl-6-chloro-2-methylpyrimidin-4-amine, 5-Allyl-4-amino-2-methyl-6-chloropyrimidine, 5-Allyl-6-chloro-2-methyl-pyrimidin-4-ylamine, 6-Chloro-2-methyl-5-(2-propenyl)-4-pyrimidinamine, 4-Pyrimidinamine, 6-chloro-2-methyl-5-(2-propenyl)-
| Molecular Formula | C8H10ClN3 |
|---|---|
| Molecular Weight | 183.06 g/mol |
| LogP | 1.74912 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.05632 |
| Heavy Atoms | 12 |
| Complexity | 286.16644 |
Chemical Identifiers
| CAS Number | 87141-85-3 |
|---|---|
| SMILES | CC1=NC(=C(C(=N1)Cl)CC=C)N |
Product Overview
6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine (CAS 87141-85-3), with molecular formula C8H10ClN3 and molecular weight 183.06 g/mol. IUPAC: 6-chloro-2-methyl-5-prop-2-enylpyrimidin-4-amine.
Chemical Property Profile of 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine
Property Insights of 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine
The XLogP value of 1.74912 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine. With a topological polar surface area (TPSA) of 51.8 Ų, 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine has 1 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 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine?
The CAS number of 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine is 87141-85-3.
What is the molecular formula of 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine?
The molecular formula of 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine is C8H10ClN3.
What is the molecular weight of 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine?
The molecular weight of 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine is 183.06 g/mol.
Where can I buy 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine?
You can request a quote for 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4(3H)-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.