3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline
TL;DR: 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline (CAS 371122-11-1) is a chemical compound with molecular formula C10H13N3 and molecular weight 175.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,4,5,6-tetrahydropyrimidin-2-yl)aniline
Also Known As: 2-(3-aminophenyl)-1,4,5,6-tetrahydropyrimidine, 3-(1,4,5,6-tetrahydropyrimidin-2-yl)aniline
| Molecular Formula | C10H13N3 |
|---|---|
| Molecular Weight | 175.11 g/mol |
| LogP | 1.0087 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 175.11095 |
| Heavy Atoms | 13 |
| Complexity | 330.6967 |
Chemical Identifiers
| CAS Number | 371122-11-1 |
|---|---|
| SMILES | C1CNC(=NC1)C2=CC(=CC=C2)N |
Product Overview
3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline (CAS 371122-11-1), with molecular formula C10H13N3 and molecular weight 175.11 g/mol. IUPAC: 3-(1,4,5,6-tetrahydropyrimidin-2-yl)aniline.
Chemical Property Profile of 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline
Property Insights of 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline
The XLogP value of 1.0087 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline. With a topological polar surface area (TPSA) of 50.41 Ų, 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline has 2 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 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline?
The CAS number of 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline is 371122-11-1.
What is the molecular formula of 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline?
The molecular formula of 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline is C10H13N3.
What is the molecular weight of 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline?
The molecular weight of 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline is 175.11 g/mol.
Where can I buy 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline?
You can request a quote for 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,4,5,6-Tetrahydropyrimidin-2-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.