BAS 01859718
TL;DR: BAS 01859718 (CAS 403658-63-9) is a chemical compound with molecular formula C18H17BrN4O4S and molecular weight 464.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(5-bromothiophen-2-yl)-N-[(E)-(2,4,5-trimethoxyphenyl)methylideneamino]-1H-pyrazole-3-carboxamide
Also Known As: BAS 01859718, 3-(5-bromothiophen-2-yl)-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]-1H-pyrazole-5-carbohydrazide, 3-(5-BR-2-THIENYL)-N'-(2,4,5-TRIMETHOXYBENZYLIDENE)-1H-PYRAZOLE-5-CARBOHYDRAZIDE, (E)-3-(5-bromothiophen-2-yl)-N'-(2,4,5-trimethoxybenzylidene)-1H-pyrazole-5-carbohydrazide, 5-(5-bromothiophen-2-yl)-N-[(E)-(2,4,5-trimethoxyphenyl)methylideneamino]-1H-pyrazole-3-carboxamide
| Molecular Formula | C18H17BrN4O4S |
|---|---|
| Molecular Weight | 464.02 g/mol |
| LogP | 3.6904 |
| Topological Polar Surface Area | 97.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 464.01538 |
| Heavy Atoms | 28 |
| Complexity | 1014.9368 |
Chemical Identifiers
| CAS Number | 403658-63-9 |
|---|---|
| SMILES | COC1=CC(=C(C=C1/C=N/NC(=O)C2=NNC(=C2)C3=CC=C(S3)Br)OC)OC |
Product Overview
BAS 01859718 (CAS 403658-63-9), with molecular formula C18H17BrN4O4S and molecular weight 464.02 g/mol. IUPAC: 5-(5-bromothiophen-2-yl)-N-[(E)-(2,4,5-trimethoxyphenyl)methylideneamino]-1H-pyrazole-3-carboxamide.
Chemical Property Profile of BAS 01859718
Property Insights of BAS 01859718
The XLogP value of 3.6904 indicates that BAS 01859718 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.83 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01859718. Following Lipinski's Rule of Five, BAS 01859718 has 2 hydrogen bond donor(s) and 7 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 01859718?
The CAS number of BAS 01859718 is 403658-63-9.
What is the molecular formula of BAS 01859718?
The molecular formula of BAS 01859718 is C18H17BrN4O4S.
What is the molecular weight of BAS 01859718?
The molecular weight of BAS 01859718 is 464.02 g/mol.
Where can I buy BAS 01859718?
You can request a quote for BAS 01859718 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01859718?
Yes, KEHONG BIO provides custom synthesis services for BAS 01859718 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.