2-[[4-(Acetylamino)phenyl]amino]-2-oxoethyl 3-[3-[(2,3-dihydro-1H-indol-1-yl)sulfonyl]-4,5-dimethoxyphenyl]-2-propenoate
Basic information
- CAS
479591-66-7- Standard SMILES
COc1cc(C=CC(=O)OCC(=O)Nc2ccc(NC(C)=O)cc2)cc(S(=O)(=O)N2CCc3ccccc32)c1OC- InChIKey
QMRQTGHCJRDBGC-UHFFFAOYSA-N- Molecular formula
- C29H29N3O8S
- Average molar mass
- 579.6 g/mol
- Monoisotopic mass
- 579.16753607
Names & identifiers
- Preferred name
- 2-[[4-(Acetylamino)phenyl]amino]-2-oxoethyl 3-[3-[(2,3-dihydro-1H-indol-1-yl)sulfonyl]-4,5-dimethoxyphenyl]-2-propenoate
- IUPAC
- [2-(4-acetamidoanilino)-2-oxoethyl] 3-[3-(2,3-dihydroindol-1-ylsulfonyl)-4,5-dimethoxyphenyl]prop-2-enoate
Names & synonyms
DTXSID801104940AKOS0306821572-[[4-(Acetylamino)phenyl]amino]-2-oxoethyl 3-[3-[(2,3-dihydro-1H-indol-1-yl)sulfonyl]-4,5-dimethoxyphenyl]-2-propenoate479591-66-7
Database identifiers
- CAS
479591-66-7- PubChem CID
- 4453965
- DTXSID
DTXSID801104940
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 149 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 11
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 1,050
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…