BAS 01076770
TL;DR: BAS 01076770 (CAS 334506-52-4) is a chemical compound with molecular formula C12H20N6O and molecular weight 264.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(2-methylpropylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]oxy]acetonitrile
Also Known As: BAS 01076770, (4-Isobutylamino-6-isopropylamino-[1,3,5]triazin-2-yloxy)-acetonitrile, ({4-[(2-methylpropyl)amino]-6-(propan-2-ylamino)-1,3,5-triazin-2-yl}oxy)acetonitrile, 2-((4-(isobutylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl)oxy)acetonitrile, 2-[[4-(2-methylpropylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]oxy]acetonitrile
| Molecular Formula | C12H20N6O |
|---|---|
| Molecular Weight | 264.17 g/mol |
| LogP | 1.66218 |
| Topological Polar Surface Area | 95.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 264.16986 |
| Heavy Atoms | 19 |
| Complexity | 440.33603 |
Chemical Identifiers
| CAS Number | 334506-52-4 |
|---|---|
| SMILES | CC(C)CNC1=NC(=NC(=N1)OCC#N)NC(C)C |
Product Overview
BAS 01076770 (CAS 334506-52-4), with molecular formula C12H20N6O and molecular weight 264.17 g/mol. IUPAC: 2-[[4-(2-methylpropylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]oxy]acetonitrile.
Chemical Property Profile of BAS 01076770
Property Insights of BAS 01076770
The XLogP value of 1.66218 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01076770. The TPSA of 95.75 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01076770. Following Lipinski's Rule of Five, BAS 01076770 has 2 hydrogen bond donor(s) and 7 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 BAS 01076770?
The CAS number of BAS 01076770 is 334506-52-4.
What is the molecular formula of BAS 01076770?
The molecular formula of BAS 01076770 is C12H20N6O.
What is the molecular weight of BAS 01076770?
The molecular weight of BAS 01076770 is 264.17 g/mol.
Where can I buy BAS 01076770?
You can request a quote for BAS 01076770 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01076770?
Yes, KEHONG BIO provides custom synthesis services for BAS 01076770 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.