2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)-
TL;DR: 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)- (CAS 501657-66-5) is a chemical compound with molecular formula C14H16ClN3 and molecular weight 261.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-6-methyl-5-(3-phenylpropyl)pyrimidin-2-amine
Also Known As: 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)-, 4-chloro-6-methyl-5-(3-phenylpropyl)pyrimidin-2-amine
| Molecular Formula | C14H16ClN3 |
|---|---|
| Molecular Weight | 261.10 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.10327 |
| Heavy Atoms | 18 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 501657-66-5 |
|---|---|
| SMILES | CC1=C(C(=NC(=N1)N)Cl)CCCC2=CC=CC=C2 |
| InChIKey | KYVHJFUQVXEYQS-UHFFFAOYSA-N |
Product Overview
2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)- (CAS 501657-66-5), with molecular formula C14H16ClN3 and molecular weight 261.10 g/mol. IUPAC: 4-chloro-6-methyl-5-(3-phenylpropyl)pyrimidin-2-amine.
Chemical Property Profile of 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)-
Property Insights of 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)-
The XLogP value of 4.0 indicates that 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)- 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 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)-?
The CAS number of 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)- is 501657-66-5.
What is the molecular formula of 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)-?
The molecular formula of 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)- is C14H16ClN3.
What is the molecular weight of 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)-?
The molecular weight of 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)- is 261.10 g/mol.
Where can I buy 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)-?
You can request a quote for 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrimidinamine, 4-chloro-6-methyl-5-(3-phenylpropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.