Anthranilic acid, N-(6-(2-aminopyrimidinyl))-
Basic information
- CAS
31185-78-1- Standard SMILES
Nc1nccc(Nc2ccccc2C(=O)O)n1- InChIKey
SOJJTFYDOCVXLS-UHFFFAOYSA-N- Molecular formula
- C11H10N4O2
- Average molar mass
- 230.22 g/mol
- Monoisotopic mass
- 230.08037557
Names & identifiers
- Preferred name
- Anthranilic acid, N-(6-(2-aminopyrimidinyl))-
- IUPAC
- 2-[(2-aminopyrimidin-4-yl)amino]benzoic acid
- English name
- 2-[(2-Amino-4-pyrimidinyl)amino]benzoic acid
- Molecular formula
- C11H10N4O2
- Molecular weight
- 230.22
Names & synonyms
31185-78-1BRN 0216806ANTHRANILIC ACID, N-(6-(2-AMINOPYRIMIDINYL))-N-(6-(2-Aminopyrimidinyl))anthranilic acidDTXSID701851165-25-12-00025 (Beilstein Handbook Reference)RefChem:319823DTXCID801076072-[(2-amino-4-pyrimidinyl)amino]benzoic acid2-[(2-aminopyrimidin-4-yl)amino]benzoic acidOprea1_327920SCHEMBL1650216
Show more names
PV-28Benzoic acid, 2-[(2-amino-4-pyrimidinyl)amino]-
SOJJTFYDOCVXLS-UHFFFAOYSA-NSBB097582AKOS0010186942-(2-Aminopyrimidin-4-ylamino)benzoic acid2-amino-4-(o-carboxyphenyl-amino)pyrimidineAG-690/12870309SR-01000222295SR-01000222295-1
Database identifiers
- CAS
31185-78-1- PubChem CID
- 35750
- DTXSID
DTXSID70185116- Nikkaji
- J55.378F
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 274
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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