5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)-
TL;DR: 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)- (CAS 89000-97-5) is a chemical compound with molecular formula C9H7NO2S and molecular weight 193.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-4-(thiophen-3-ylmethylidene)-1,3-oxazol-5-one
Also Known As: 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)-, AN-037/15477028, 2-methyl-4-(thiophen-3-ylmethylidene)-1,3-oxazol-5-one, 2-Methyl-4-[(thiophen-3-yl)methylidene]-1,3-oxazol-5(4H)-one
| Molecular Formula | C9H7NO2S |
|---|---|
| Molecular Weight | 193.02 g/mol |
| LogP | 2.0642 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.01974 |
| Heavy Atoms | 13 |
| Complexity | 389.75702 |
Chemical Identifiers
| CAS Number | 89000-97-5 |
|---|---|
| SMILES | CC1=NC(=CC2=CSC=C2)C(=O)O1 |
Product Overview
5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)- (CAS 89000-97-5), with molecular formula C9H7NO2S and molecular weight 193.02 g/mol. IUPAC: 2-methyl-4-(thiophen-3-ylmethylidene)-1,3-oxazol-5-one.
Chemical Property Profile of 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)-
Property Insights of 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)-
The XLogP value of 2.0642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)-. With a topological polar surface area (TPSA) of 38.66 Ų, 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)- has 0 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 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)-?
The CAS number of 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)- is 89000-97-5.
What is the molecular formula of 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)-?
The molecular formula of 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)- is C9H7NO2S.
What is the molecular weight of 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)-?
The molecular weight of 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)- is 193.02 g/mol.
Where can I buy 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)-?
You can request a quote for 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)-?
Yes, KEHONG BIO provides custom synthesis services for 5(4H)-Oxazolone, 2-methyl-4-(3-thienylmethylene)-, (Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.