4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)-
TL;DR: 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)- (CAS 85826-35-3) is a chemical compound with molecular formula C9H12ClN3 and molecular weight 197.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-N,2-dimethyl-5-prop-2-enylpyrimidin-4-amine
Also Known As: 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)-, 6-Chloro-N,2-dimethyl-5-(2-propenyl)-4-pyrimidinamine, 6-chloro-N,2-dimethyl-5-(prop-2-en-1-yl)pyrimidin-4-amine, 6-chloro-N,2-dimethyl-5-prop-2-enylpyrimidin-4-amine, BRN 5005909
| Molecular Formula | C9H12ClN3 |
|---|---|
| Molecular Weight | 197.07 g/mol |
| LogP | 2.20862 |
| Topological Polar Surface Area | 37.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 197.07198 |
| Heavy Atoms | 13 |
| Complexity | 322.881 |
Chemical Identifiers
| CAS Number | 85826-35-3 |
|---|---|
| SMILES | CC1=NC(=C(C(=N1)Cl)CC=C)NC |
Product Overview
4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)- (CAS 85826-35-3), with molecular formula C9H12ClN3 and molecular weight 197.07 g/mol. IUPAC: 6-chloro-N,2-dimethyl-5-prop-2-enylpyrimidin-4-amine.
Chemical Property Profile of 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)-
Property Insights of 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)-
The XLogP value of 2.20862 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)-. With a topological polar surface area (TPSA) of 37.81 Ų, 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)- 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 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)-?
The CAS number of 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)- is 85826-35-3.
What is the molecular formula of 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)-?
The molecular formula of 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)- is C9H12ClN3.
What is the molecular weight of 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)-?
The molecular weight of 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)- is 197.07 g/mol.
Where can I buy 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)-?
You can request a quote for 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyrimidinamine, 6-chloro-N,2-dimethyl-5-(2-propenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.