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6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile
TL;DR: 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile (CAS 496771-70-1) is a chemical compound with molecular formula C12H16N4O and molecular weight 232.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-3-ethyl-4-propan-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Also Known As: BAS 06900958, 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-3-ethyl-4-propan-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-3-ethyl-4-(propan-2-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-3-ethyl-4-isopropyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
| Molecular Formula | C12H16N4O |
|---|---|
| Molecular Weight | 232.13 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.13242 |
| Heavy Atoms | 17 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 496771-70-1 |
|---|---|
| SMILES | CCC1=C2C(C(=C(OC2=NN1)N)C#N)C(C)C |
| InChIKey | IEARBULSCUBXKT-UHFFFAOYSA-N |
Product Overview
6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile (CAS 496771-70-1), with molecular formula C12H16N4O and molecular weight 232.13 g/mol. IUPAC: 6-amino-3-ethyl-4-propan-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
Chemical Property Profile of 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile
Property Insights of 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile. Following Lipinski's Rule of Five, 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile 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 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile?
The CAS number of 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile is 496771-70-1.
What is the molecular formula of 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile?
The molecular formula of 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile is C12H16N4O.
What is the molecular weight of 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile?
The molecular weight of 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile is 232.13 g/mol.
Where can I buy 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile?
You can request a quote for 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Amino-3-ethyl-4-isopropyl-2,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.