2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)-
TL;DR: 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)- (CAS 3977-17-1) is a chemical compound with molecular formula C14H18N4 and molecular weight 242.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-5-(3-phenylpropyl)pyrimidine-2,4-diamine
Also Known As: 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)-, C(CCc1ccccc1)c2c(C)nc(N)nc2N, Bis-(2-diethylamino-ethyl)-sulfoxyd, 6-methyl-5-(3-phenylpropyl)pyrimidine-2,4-diamine, NCI60_001763
| Molecular Formula | C14H18N4 |
|---|---|
| Molecular Weight | 242.15 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.15315 |
| Heavy Atoms | 18 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 3977-17-1 |
|---|---|
| SMILES | CC1=C(C(=NC(=N1)N)N)CCCC2=CC=CC=C2 |
| InChIKey | ZOLRHOYGCWXBKL-UHFFFAOYSA-N |
Product Overview
2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)- (CAS 3977-17-1), with molecular formula C14H18N4 and molecular weight 242.15 g/mol. IUPAC: 6-methyl-5-(3-phenylpropyl)pyrimidine-2,4-diamine.
Chemical Property Profile of 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)-
Property Insights of 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)-. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)-. Following Lipinski's Rule of Five, 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)- has 2 hydrogen bond donor(s) and 4 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 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)-?
The CAS number of 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)- is 3977-17-1.
What is the molecular formula of 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)-?
The molecular formula of 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)- is C14H18N4.
What is the molecular weight of 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)-?
The molecular weight of 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)- is 242.15 g/mol.
Where can I buy 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)-?
You can request a quote for 2,4-Pyrimidinediamine, 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 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.