Basic information
- Standard SMILES
COC(CN(C(=O)Nc1nc(C)c(C(=O)NCc2ccccc2)s1)c1ccc(F)cc1)OC- InChIKey
BMKDGRKAGDPSRI-UHFFFAOYSA-N- Molecular formula
- C23H25FN4O4S
- Average molar mass
- 472.5 g/mol
- Monoisotopic mass
- 472.15805463
Names & identifiers
- Preferred name
- N-benzyl-2-(3-(2,2-dimethoxyethyl)-3-(4-fluorophenyl)ureido)-4-methylthiazole-5-carboxamide
- IUPAC
- N-benzyl-2-[[2,2-dimethoxyethyl-(4-fluorophenyl)carbamoyl]amino]-4-methyl-1,3-thiazole-5-carboxamide
Names & synonyms
SCHEMBL245265BMKDGRKAGDPSRI-UHFFFAOYSA-NN-benzyl-2-(3-(2,2-dimethoxyethyl)-3-(4-fluorophenyl)ureido)-4-methylthiazole-5-carboxamide
Database identifiers
- PubChem CID
- 86645283
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 628
Related reactions
3 records
Compound notes
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