BAS 02060186
TL;DR: BAS 02060186 (CAS 244299-22-7) is a chemical compound with molecular formula C17H17NO4 and molecular weight 299.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (4Z)-2-methyl-5-oxo-4-[(4-prop-2-enoxyphenyl)methylidene]-1H-pyrrole-3-carboxylate
Also Known As: BAS 02060186, BIM-0046980.P001, (Z)-methyl 4-(4-(allyloxy)benzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate, methyl (4Z)-2-methyl-5-oxo-4-[(4-prop-2-enoxyphenyl)methylidene]-1H-pyrrole-3-carboxylate, methyl (4Z)-2-methyl-5-oxo-4-[4-(prop-2-en-1-yloxy)benzylidene]-4,5-dihydro-1H-pyrrole-3-carboxylate
| Molecular Formula | C17H17NO4 |
|---|---|
| Molecular Weight | 299.12 g/mol |
| LogP | 2.2116 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 299.11575 |
| Heavy Atoms | 22 |
| Complexity | 668.4043 |
Chemical Identifiers
| CAS Number | 244299-22-7 |
|---|---|
| SMILES | CC1=C(/C(=C/C2=CC=C(C=C2)OCC=C)/C(=O)N1)C(=O)OC |
Product Overview
BAS 02060186 (CAS 244299-22-7), with molecular formula C17H17NO4 and molecular weight 299.12 g/mol. IUPAC: methyl (4Z)-2-methyl-5-oxo-4-[(4-prop-2-enoxyphenyl)methylidene]-1H-pyrrole-3-carboxylate.
Chemical Property Profile of BAS 02060186
Property Insights of BAS 02060186
The XLogP value of 2.2116 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02060186. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02060186. Following Lipinski's Rule of Five, BAS 02060186 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 02060186?
The CAS number of BAS 02060186 is 244299-22-7.
What is the molecular formula of BAS 02060186?
The molecular formula of BAS 02060186 is C17H17NO4.
What is the molecular weight of BAS 02060186?
The molecular weight of BAS 02060186 is 299.12 g/mol.
Where can I buy BAS 02060186?
You can request a quote for BAS 02060186 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02060186?
Yes, KEHONG BIO provides custom synthesis services for BAS 02060186 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.