Basic information
- CAS
180741-00-8- Standard SMILES
CC(=O)c1cc(Nc2cc(C)nc(N)n2)cc(C(C)=O)c1- InChIKey
DGKHVUISKJMDOJ-UHFFFAOYSA-N- Molecular formula
- C15H16N4O2
- Average molar mass
- 284.31 g/mol
- Monoisotopic mass
- 284.12732577
Names & identifiers
- Preferred name
- Cni H1194
- IUPAC
- 1-[3-acetyl-5-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]ethanone
Names & synonyms
Cni H1194Cni-H1194180741-00-8DTXSID40171006RefChem:127179DTXCID80934972-Amino-4-(3,5-diacetylphenyl)amino-6-methylpyrimidineNSC7423051-[3-acetyl-5-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]ethanoneSCHEMBL3500528DGKHVUISKJMDOJ-UHFFFAOYSA-NCNI-H 1194
Show more names
Pyrimidine, 2-amino-4-(3,5-diacetylphenyl)amino-6-methyl-CNI 1194CNI-11941-[3-acetyl-5-[(2-amino-6-methyl-pyrimidin-4-yl)amino]phenyl]ethanone1,1'-{5-[(2-Amino-6-methylpyrimidin-4-yl)amino]-1,3-phenylene}di(ethan-1-one)Ethanone, 1,1'-[5-[(2-amino-6-methyl-4-pyrimidinyl)amino]-1,3-phenylene]bis-
Database identifiers
- CAS
180741-00-8- PubChem CID
- 133109
- DTXSID
DTXSID40171006- Nikkaji
- J791.459H
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 98 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 379
Related reactions
9 records
Compound notes
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