Ethyl 5-methyl-3-(phenylamino)-2,4-thiazole-carboxylate - CAS 15865-96-0
Catalog: |
BB043279 |
Product Name: |
Ethyl 5-methyl-3-(phenylamino)-2,4-thiazole-carboxylate |
CAS: |
15865-96-0 |
Synonyms: |
MLS000534439; Eethyl 4-methyl-2-(phenylamino)thiazole-5-carboxylate |
IUPAC Name: | ethyl 2-anilino-4-methyl-1,3-thiazole-5-carboxylate |
Description: | Ethyl 5-methyl-3-(phenylamino)-2,4-thiazole-carboxylate (CAS# 15865-96-0 ) is a useful research chemical. |
Molecular Weight: | 262.33 |
Molecular Formula: | C13H14N2O2S |
Canonical SMILES: | CCOC(=O)C1=C(N=C(S1)NC2=CC=CC=C2)C |
InChI: | InChI=1S/C13H14N2O2S/c1-3-17-12(16)11-9(2)14-13(18-11)15-10-7-5-4-6-8-10/h4-8H,3H2,1-2H3,(H,14,15) |
InChI Key: | VQXNEYSGMWEITA-UHFFFAOYSA-N |
Complexity: | 282 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 262.07759887 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 262.07759887 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 79.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.8 |
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