N-[9-(2-Dimethylamino-ethylamino)-7-(3-pyrrolidin-1-yl-propionylamino)-acridin-2-yl]-3-pyrrolidin-1-yl-propionamide
Basic information
- CAS
607732-62-7- Standard SMILES
CN(C)CCNc1c2cc(NC(=O)CCN3CCCC3)ccc2nc2ccc(NC(=O)CCN3CCCC3)cc12- InChIKey
YKRVZCROPBYFKJ-UHFFFAOYSA-N- Molecular formula
- C31H43N7O2
- Average molar mass
- 545.7 g/mol
- Monoisotopic mass
- 545.34782364
Names & identifiers
- Preferred name
- N-[9-(2-Dimethylamino-ethylamino)-7-(3-pyrrolidin-1-yl-propionylamino)-acridin-2-yl]-3-pyrrolidin-1-yl-propionamide
- IUPAC
- N-[9-[2-(dimethylamino)ethylamino]-7-(3-pyrrolidin-1-ylpropanoylamino)acridin-2-yl]-3-pyrrolidin-1-ylpropanamide
Names & synonyms
CHEMBL137928607732-62-7N-[9-(2-Dimethylamino-ethylamino)-7-(3-pyrrolidin-1-yl-propionylamino)-acridin-2-yl]-3-pyrrolidin-1-yl-propionamideDTXSID301126531BDBM50134005N,Na(2)-[9-[[2-(Dimethylamino)ethyl]amino]-2,7-acridinediyl]bis[1-pyrrolidinepropanamide]N,N''-(9-(2-(dimethylamino)ethylamino)acridine-2,7-diyl)bis(3-(pyrrolidin-1-yl)propanamide)N,N'-(9-{[2-(Dimethylamino)ethyl]amino}acridine-2,7-diyl)bis[3-(pyrrolidin-1-yl)propanamide]
Database identifiers
- CAS
607732-62-7- PubChem CID
- 11049871
- DTXSID
DTXSID301126531- ChEMBL
CHEMBL137928
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 92.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 12
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 756
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…