BAS 09914819
TL;DR: BAS 09914819 (CAS 810627-44-2) is a chemical compound with molecular formula C21H16F3N5O2 and molecular weight 427.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzoxazol-2-ylamino)-4,6-dimethyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide
Also Known As: BAS 09914819, AB01311278-01, 2-(1,3-benzoxazol-2-ylamino)-4,6-dimethyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide, 2-(benzo[d]oxazol-2-ylamino)-4,6-dimethyl-N-(3-(trifluoromethyl)phenyl)pyrimidine-5-carboxamide, 2-[(1,3-BENZOXAZOL-2-YL)AMINO]-4,6-DIMETHYL-N-[3-(TRIFLUOROMETHYL)PHENYL]PYRIMIDINE-5-CARBOXAMIDE
| Molecular Formula | C21H16F3N5O2 |
|---|---|
| Molecular Weight | 427.13 g/mol |
| LogP | 5.24934 |
| Topological Polar Surface Area | 92.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 427.1256 |
| Heavy Atoms | 31 |
| Complexity | 1227.4869 |
Chemical Identifiers
| CAS Number | 810627-44-2 |
|---|---|
| SMILES | CC1=C(C(=NC(=N1)NC2=NC3=CC=CC=C3O2)C)C(=O)NC4=CC=CC(=C4)C(F)(F)F |
Product Overview
BAS 09914819 (CAS 810627-44-2), with molecular formula C21H16F3N5O2 and molecular weight 427.13 g/mol. IUPAC: 2-(1,3-benzoxazol-2-ylamino)-4,6-dimethyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide.
Chemical Property Profile of BAS 09914819
Property Insights of BAS 09914819
The XLogP value of 5.24934 indicates that BAS 09914819 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.94 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09914819. Following Lipinski's Rule of Five, BAS 09914819 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 09914819?
The CAS number of BAS 09914819 is 810627-44-2.
What is the molecular formula of BAS 09914819?
The molecular formula of BAS 09914819 is C21H16F3N5O2.
What is the molecular weight of BAS 09914819?
The molecular weight of BAS 09914819 is 427.13 g/mol.
Where can I buy BAS 09914819?
You can request a quote for BAS 09914819 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09914819?
Yes, KEHONG BIO provides custom synthesis services for BAS 09914819 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.