Urea, 1-phenyl-3-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-2-thio-
Basic information
- CAS
31652-21-8- Standard SMILES
Cn1c(NC(=S)Nc2ccccc2)cc(=O)n(C)c1=O- InChIKey
OMULIKWVUGOJBQ-UHFFFAOYSA-N- Molecular formula
- C13H14N4O2S
- Average molar mass
- 290.34 g/mol
- Monoisotopic mass
- 290.08374688
Names & identifiers
- Preferred name
- Urea, 1-phenyl-3-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-2-thio-
- IUPAC
- 1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-3-phenylthiourea
Names & synonyms
Uracil, 1,3-dimethyl-5-(phenylthiourea)-Urea, 1-phenyl-3-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-2-thio-31652-21-8DTXSID301855361-(2,4-Diketo-1,3-dimethyl-1,2,3,4-tetrahydropyrimidin-6-yl)-3-phenyl-2-thiourea1-Phenyl-3-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-2-thioureaRefChem:387640DTXCID70108027N-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-N'-phenylthiourea
Database identifiers
- CAS
31652-21-8- PubChem CID
- 3038166
- DTXSID
DTXSID30185536
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 96.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 457
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Compound notes
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