BRN 0708661
TL;DR: BRN 0708661 (CAS 30146-69-1) is a chemical compound with molecular formula C17H22N6 and molecular weight 310.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-(pyrrolidin-1-ylmethyl)-1,3,5-triazin-2-amine
Also Known As: 5-26-09-00261 (Beilstein Handbook Reference), Isoquinoline, 1,2,3,4-tetrahydro-2-(4-amino-6-(1-pyrrolidinylmethyl)-s-triazin-2-yl)-, 1,2,3,4-Tetrahydro-2-(4-amino-6-(1-pyrrolidinylmethyl)-s-triazin-2-yl)isoquinoline, 4-(3,4-Dihydroisoquinolin-2(1H)-yl)-6-(pyrrolidin-1-ylmethyl)-1,3,5-triazin-2-amine, 1,3,5-Triazin-2-amine,4-(3,4-dihydro-2(1H)-isoquinolinyl)-6-(1-pyrrolidinylmethyl)-
| Molecular Formula | C17H22N6 |
|---|---|
| Molecular Weight | 310.19 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 71.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.19058 |
| Heavy Atoms | 23 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 30146-69-1 |
|---|---|
| SMILES | C1CCN(C1)CC2=NC(=NC(=N2)N3CCC4=CC=CC=C4C3)N |
| InChIKey | DYBYNITZVGOVGU-UHFFFAOYSA-N |
Product Overview
BRN 0708661 (CAS 30146-69-1), with molecular formula C17H22N6 and molecular weight 310.19 g/mol. IUPAC: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-(pyrrolidin-1-ylmethyl)-1,3,5-triazin-2-amine.
Chemical Property Profile of BRN 0708661
Property Insights of BRN 0708661
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BRN 0708661. The TPSA of 71.2 Ų falls within the moderate polarity range, balancing permeability and solubility for BRN 0708661. Following Lipinski's Rule of Five, BRN 0708661 has 1 hydrogen bond donor(s) and 6 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 BRN 0708661?
The CAS number of BRN 0708661 is 30146-69-1.
What is the molecular formula of BRN 0708661?
The molecular formula of BRN 0708661 is C17H22N6.
What is the molecular weight of BRN 0708661?
The molecular weight of BRN 0708661 is 310.19 g/mol.
Where can I buy BRN 0708661?
You can request a quote for BRN 0708661 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRN 0708661?
Yes, KEHONG BIO provides custom synthesis services for BRN 0708661 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.