2-amino-1-N,9-N-bis[2-(4-methoxyphenyl)ethyl]-4,6-dimethyl-3-oxophenoxazine-1,9-dicarboxamide
Basic information
- CAS
63879-44-7- Standard SMILES
COc1ccc(CCNC(=O)c2c3nc4c(C(=O)NCCc5ccc(OC)cc5)ccc(C)c4oc-3c(C)c(=O)c2N)cc1- InChIKey
SPXDFBWNQGMYSU-UHFFFAOYSA-N- Molecular formula
- C34H34N4O6
- Average molar mass
- 594.7 g/mol
- Monoisotopic mass
- 594.24783482
Names & identifiers
- Preferred name
- 2-amino-1-N,9-N-bis[2-(4-methoxyphenyl)ethyl]-4,6-dimethyl-3-oxophenoxazine-1,9-dicarboxamide
- IUPAC
- 2-amino-1-N,9-N-bis[2-(4-methoxyphenyl)ethyl]-4,6-dimethyl-3-oxophenoxazine-1,9-dicarboxamide
Names & synonyms
63879-44-7NSC2699822-amino-1-N,9-N-bis[2-(4-methoxyphenyl)ethyl]-4,6-dimethyl-3-oxophenoxazine-1,9-dicarboxamideDTXSID00313400NSC-2699822-Amino-N~1~,N~9~-bis[2-(4-methoxyphenyl)ethyl]-4,6-dimethyl-3-oxo-3H-phenoxazine-1,9-dicarboxamide
Database identifiers
- CAS
63879-44-7- PubChem CID
- 320853
- DTXSID
DTXSID00313400
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 141 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 1,180
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Compound notes
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