BAS 09530339
TL;DR: BAS 09530339 (CAS 445034-96-8) is a chemical compound with molecular formula C16H15F2N5O and molecular weight 331.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(difluoromethyl)-N-(2,3-dimethylphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: BAS 09530339, 7-(difluoromethyl)-N-(2,3-dimethylphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide, 7-(difluoromethyl)-N-(2,3-dimethylphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
| Molecular Formula | C16H15F2N5O |
|---|---|
| Molecular Weight | 331.12 g/mol |
| LogP | 3.23946 |
| Topological Polar Surface Area | 72.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.12448 |
| Heavy Atoms | 24 |
| Complexity | 935.6076 |
Chemical Identifiers
| CAS Number | 445034-96-8 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NC(=O)C2=NN3C(=CC(=NC3=N2)C)C(F)F)C |
Product Overview
BAS 09530339 (CAS 445034-96-8), with molecular formula C16H15F2N5O and molecular weight 331.12 g/mol. IUPAC: 7-(difluoromethyl)-N-(2,3-dimethylphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of BAS 09530339
Property Insights of BAS 09530339
The XLogP value of 3.23946 indicates that BAS 09530339 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.18 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09530339. Following Lipinski's Rule of Five, BAS 09530339 has 1 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 09530339?
The CAS number of BAS 09530339 is 445034-96-8.
What is the molecular formula of BAS 09530339?
The molecular formula of BAS 09530339 is C16H15F2N5O.
What is the molecular weight of BAS 09530339?
The molecular weight of BAS 09530339 is 331.12 g/mol.
Where can I buy BAS 09530339?
You can request a quote for BAS 09530339 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09530339?
Yes, KEHONG BIO provides custom synthesis services for BAS 09530339 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.