BAS 07094048
TL;DR: BAS 07094048 (CAS 313379-50-9) is a chemical compound with molecular formula C17H17FN4O and molecular weight 312.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-3-tert-butyl-4-(3-fluorophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Also Known As: BAS 07094048, AB00092928-01, 6-amino-3-(tert-butyl)-4-(3-fluorophenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-3-tert-butyl-4-(3-fluorophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-3-(tert-butyl)-4-(3-fluorophenyl)-4H-pyrano[2,3-c]pyrazole-5-carbonitr ile
| Molecular Formula | C17H17FN4O |
|---|---|
| Molecular Weight | 312.14 g/mol |
| LogP | 3.06448 |
| Topological Polar Surface Area | 87.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 312.13864 |
| Heavy Atoms | 23 |
| Complexity | 839.0087 |
Chemical Identifiers
| CAS Number | 313379-50-9 |
|---|---|
| SMILES | CC(C)(C)C1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=CC=C3)F |
Product Overview
BAS 07094048 (CAS 313379-50-9), with molecular formula C17H17FN4O and molecular weight 312.14 g/mol. IUPAC: 6-amino-3-tert-butyl-4-(3-fluorophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
Chemical Property Profile of BAS 07094048
Property Insights of BAS 07094048
The XLogP value of 3.06448 indicates that BAS 07094048 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 07094048. Following Lipinski's Rule of Five, BAS 07094048 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 07094048?
The CAS number of BAS 07094048 is 313379-50-9.
What is the molecular formula of BAS 07094048?
The molecular formula of BAS 07094048 is C17H17FN4O.
What is the molecular weight of BAS 07094048?
The molecular weight of BAS 07094048 is 312.14 g/mol.
Where can I buy BAS 07094048?
You can request a quote for BAS 07094048 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07094048?
Yes, KEHONG BIO provides custom synthesis services for BAS 07094048 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.