Basic information
- CAS
20632-57-9- Standard SMILES
O=C(Nc1ccccc1)Nc1cccc(C(=O)O)c1- InChIKey
NPUMZPHLELCFCT-UHFFFAOYSA-N- Molecular formula
- C14H12N2O3
- Average molar mass
- 256.26 g/mol
- Monoisotopic mass
- 256.08479225
Names & identifiers
- Preferred name
- Benzoic acid, m-(1-phenylureido)-
- IUPAC
- 3-(phenylcarbamoylamino)benzoic acid
- English name
- Benzoic acid, 3-[[(phenylamino)carbonyl]amino]-
- Molecular formula
- C14H12N2O3
- Molecular weight
- 256.26
Names & synonyms
RefChem:1079215Benzoic acid, m-(1-phenylureido)-20632-57-9Benzoic acid, 3-[[(phenylamino)carbonyl]amino]-3-[(anilinocarbonyl)amino]benzoic acid3-(phenylcarbamoylamino)benzoic acidNSC 836253-[(phenylcarbamoyl)amino]benzoic acidOprea1_723084CHEMBL572764SCHEMBL6821211DTXSID701384579
Show more names
AKOS000138248
Database identifiers
- CAS
20632-57-9、73713-68-5- PubChem CID
- 52272
- DTXSID
DTXSID701384579- ChEMBL
CHEMBL572764- Nikkaji
- J3.709.704G
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 327
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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