BAS 01095384
TL;DR: BAS 01095384 (CAS 336177-23-2) is a chemical compound with molecular formula C19H16N4OS and molecular weight 348.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-2-(1,3-benzothiazol-2-yl)-4-(dimethylaminomethylidene)-5-phenylpyrazol-3-one
Also Known As: BAS 01095384, (4E)-2-(1,3-benzothiazol-2-yl)-4-(dimethylaminomethylidene)-5-phenylpyrazol-3-one, (E)-1-(benzo[d]thiazol-2-yl)-4-((dimethylamino)methylene)-3-phenyl-1H-pyrazol-5(4H)-one, 2-Benzothiazol-2-yl-4-dimethylaminomethylene-5-phenyl-2,4-dihydro-pyrazol-3-one, (4E)-1-(1,3-BENZOTHIAZOL-2-YL)-4-[(DIMETHYLAMINO)METHYLIDENE]-3-PHENYL-4,5-DIHYDRO-1H-PYRAZOL-5-ONE
| Molecular Formula | C19H16N4OS |
|---|---|
| Molecular Weight | 348.10 g/mol |
| LogP | 3.4927 |
| Topological Polar Surface Area | 48.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.1045 |
| Heavy Atoms | 25 |
| Complexity | 971.4507 |
Chemical Identifiers
| CAS Number | 336177-23-2 |
|---|---|
| SMILES | CN(C)/C=C/1\C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C4=CC=CC=C4 |
Product Overview
BAS 01095384 (CAS 336177-23-2), with molecular formula C19H16N4OS and molecular weight 348.10 g/mol. IUPAC: (4E)-2-(1,3-benzothiazol-2-yl)-4-(dimethylaminomethylidene)-5-phenylpyrazol-3-one.
Chemical Property Profile of BAS 01095384
Property Insights of BAS 01095384
The XLogP value of 3.4927 indicates that BAS 01095384 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.8 Ų, BAS 01095384 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01095384 has 0 hydrogen bond donor(s) and 5 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 01095384?
The CAS number of BAS 01095384 is 336177-23-2.
What is the molecular formula of BAS 01095384?
The molecular formula of BAS 01095384 is C19H16N4OS.
What is the molecular weight of BAS 01095384?
The molecular weight of BAS 01095384 is 348.10 g/mol.
Where can I buy BAS 01095384?
You can request a quote for BAS 01095384 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01095384?
Yes, KEHONG BIO provides custom synthesis services for BAS 01095384 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.