Basic information
- Standard SMILES
CCOC(=O)CCNC(=O)Nc1nc(C)c(-c2ccnc(N3CCOCC3)c2)s1- InChIKey
VCXIMIGFKKIBCD-UHFFFAOYSA-N- Molecular formula
- C19H25N5O4S
- Average molar mass
- 419.5 g/mol
Names & identifiers
- Preferred name
- 3-{3-[4-Methyl-5-(2-morpholin-4-yl-pyridin-4-yl)-thiazol-2-yl]-ureido}-propionic acid ethyl ester
- IUPAC
- ethyl 3-[[4-methyl-5-(2-morpholin-4-yl-4-pyridinyl)-1,3-thiazol-2-yl]carbamoylamino]propanoate
Names & synonyms
SCHEMBL1891436VCXIMIGFKKIBCD-UHFFFAOYSA-N3-{3-[4-Methyl-5-(2-morpholin-4-yl-pyridin-4-yl)-thiazol-2-yl]-ureido}-propionic acid ethyl ester
Database identifiers
- PubChem CID
- 11247129
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 549
Related reactions
6 records
Compound notes
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