Butyl 5-amino-2-[(cyclohexylmethyl)(methylcarbamoyl)amino]-1,3-thiazole-4-carboxylate
Basic information
- CAS
6315-66-8- Standard SMILES
CCCCOC(=O)c1nc(N(CC2CCCCC2)C(=O)NC)sc1N- InChIKey
ZMSIPFVMGFKZPJ-UHFFFAOYSA-N- Molecular formula
- C17H28N4O3S
- Average molar mass
- 368.5 g/mol
- Monoisotopic mass
- 368.18821194
Names & identifiers
- Preferred name
- Butyl 5-amino-2-[(cyclohexylmethyl)(methylcarbamoyl)amino]-1,3-thiazole-4-carboxylate
- IUPAC
- butyl 5-amino-2-[cyclohexylmethyl(methylcarbamoyl)amino]-1,3-thiazole-4-carboxylate
Names & synonyms
6315-66-8NSC21007butyl 5-amino-2-[(cyclohexylmethyl)(methylcarbamoyl)amino]-1,3-thiazole-4-carboxylateDTXSID40281255NSC-21007
Database identifiers
- CAS
6315-66-8- PubChem CID
- 228249
- DTXSID
DTXSID40281255
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 446
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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