GLYCINE, N-(DIBENZ(a,h)ANTHRACEN-7-YLCARBAMOYL)-

HCID 44362

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Basic information

CAS: 63041-44-1
Standard SMILES: O=C(O)CNC(=O)Nc1c2ccc3ccccc3c2cc2ccc3ccccc3c12
InChIKey: BKZKQUSLMPCYIT-UHFFFAOYSA-N
Molecular formula: C25H18N2O3
Average molar mass: 394.4 g/mol
Monoisotopic mass: 394.13174244

Names & identifiers

Preferred name: GLYCINE, N-(DIBENZ(a,h)ANTHRACEN-7-YLCARBAMOYL)-
IUPAC: 2-(naphtho[1,2-b]phenanthren-14-ylcarbamoylamino)acetic acid

Names & synonyms

BRN 3534472GLYCINE, N-(DIBENZ(a,h)ANTHRACEN-7-YLCARBAMOYL)-63041-44-1N-(Dibenz(a,h)anthracen-7-ylcarbamoyl)glycine1:2:5:6-Dibenzanthracene-9-carbamido-acetic acid3-07-00-02904 (Beilstein Handbook Reference)DTXSID30212356N-[(Benzo[k]tetraphen-7-yl)carbamoyl]glycine

Database identifiers

CAS: 63041-44-1
PubChem CID: 44362
DTXSID: DTXSID30212356
Nikkaji: J75.697K

Properties

Computed structural properties

XLogP: 5.5
Topological polar surface area: 78.4 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 30
Formal charge: 0
Complexity: 652

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