2-[4-[4-[3-Methyl-4-(1-phenylethoxycarbonylamino)-1,2-oxazol-5-yl]phenyl]phenyl]acetic acid
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Basic information
- Standard SMILES
Cc1noc(-c2ccc(-c3ccc(CC(=O)O)cc3)cc2)c1NC(=O)OC(C)c1ccccc1- InChIKey
LNDDRUPAICPXIN-UHFFFAOYSA-N- Molecular formula
- C27H24N2O5
- Average molar mass
- 456.5 g/mol
Names & identifiers
- Preferred name
- 2-[4-[4-[3-Methyl-4-(1-phenylethoxycarbonylamino)-1,2-oxazol-5-yl]phenyl]phenyl]acetic acid
- IUPAC
- 2-[4-[4-[3-methyl-4-(1-phenylethoxycarbonylamino)-1,2-oxazol-5-yl]phenyl]phenyl]acetic acid
Names & synonyms
AM095 free acid?SCHEMBL2288090HMS3748G11IJD55400DB-124508S6633
Database identifiers
- PubChem CID
- 46239307
Properties
Computed structural propertiesFilling in
- XLogP
- 5
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 666
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Related reactions
1 records
Compound notes
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