BAS 00989749
TL;DR: BAS 00989749 (CAS 312266-97-0) is a chemical compound with molecular formula C20H16N4O and molecular weight 328.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-4-(4-methylphenyl)-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Also Known As: BAS 00989749, J3.663.098A, 6-amino-4-(4-methylphenyl)-3-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, A1692/0072211, 6-amino-4-(4-methylphenyl)-3-phenyl-1H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile
| Molecular Formula | C20H16N4O |
|---|---|
| Molecular Weight | 328.13 g/mol |
| LogP | 3.6033 |
| Topological Polar Surface Area | 87.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.13242 |
| Heavy Atoms | 25 |
| Complexity | 994.4255 |
Chemical Identifiers
| CAS Number | 312266-97-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2C(=C(OC3=NNC(=C23)C4=CC=CC=C4)N)C#N |
Product Overview
BAS 00989749 (CAS 312266-97-0), with molecular formula C20H16N4O and molecular weight 328.13 g/mol. IUPAC: 6-amino-4-(4-methylphenyl)-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
Chemical Property Profile of BAS 00989749
Property Insights of BAS 00989749
The XLogP value of 3.6033 indicates that BAS 00989749 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.72 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00989749. Following Lipinski's Rule of Five, BAS 00989749 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 BAS 00989749?
The CAS number of BAS 00989749 is 312266-97-0.
What is the molecular formula of BAS 00989749?
The molecular formula of BAS 00989749 is C20H16N4O.
What is the molecular weight of BAS 00989749?
The molecular weight of BAS 00989749 is 328.13 g/mol.
Where can I buy BAS 00989749?
You can request a quote for BAS 00989749 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00989749?
Yes, KEHONG BIO provides custom synthesis services for BAS 00989749 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.