BAS 00247434
TL;DR: BAS 00247434 (CAS 324017-49-4) is a chemical compound with molecular formula C19H18Cl3N5O3S and molecular weight 501.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamothioylamino]ethyl]furan-2-carboxamide
Also Known As: BAS 00247434, N-[2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamothioylamino]ethyl]furan-2-carboxamide, N-[2,2,2-trichloro-1-({[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]carbonothioyl}amino)ethyl]-2-furamide, N-[2,2,2-trichloro-1-({[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]carbothioyl}amino)ethyl]-2-furamide, N-(2,2,2-TRICHLORO-1-{[(1,5-DIMETHYL-3-OXO-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOL-4-YL)CARBAMOTHIOYL]AMINO}ETHYL)FURAN-2-CARBOXAMIDE
| Molecular Formula | C19H18Cl3N5O3S |
|---|---|
| Molecular Weight | 501.02 g/mol |
| LogP | 3.49012 |
| Topological Polar Surface Area | 93.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 501.0196 |
| Heavy Atoms | 31 |
| Complexity | 1137.2427 |
Chemical Identifiers
| CAS Number | 324017-49-4 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C3=CC=CO3 |
Product Overview
BAS 00247434 (CAS 324017-49-4), with molecular formula C19H18Cl3N5O3S and molecular weight 501.02 g/mol. IUPAC: N-[2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamothioylamino]ethyl]furan-2-carboxamide.
Chemical Property Profile of BAS 00247434
Property Insights of BAS 00247434
The XLogP value of 3.49012 indicates that BAS 00247434 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.23 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00247434. Following Lipinski's Rule of Five, BAS 00247434 has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00247434?
The CAS number of BAS 00247434 is 324017-49-4.
What is the molecular formula of BAS 00247434?
The molecular formula of BAS 00247434 is C19H18Cl3N5O3S.
What is the molecular weight of BAS 00247434?
The molecular weight of BAS 00247434 is 501.02 g/mol.
Where can I buy BAS 00247434?
You can request a quote for BAS 00247434 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00247434?
Yes, KEHONG BIO provides custom synthesis services for BAS 00247434 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.