Netropsin
N-[5-[(3-amino-3-iminopropyl)carbamoyl]-1-methylpyrrol-3-yl]-4-[[2-(diaminomethylideneamino)acetyl]amino]-1-methylpyrrole-2-carboxamide
| Molecular Formula | C18H26N10O3 |
|---|---|
| Molecular Weight | 430.5 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 211.0 A2 |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 430.21893 |
| Heavy Atoms | 31 |
| Complexity | 723.0 |
Chemical Identifiers
| CAS Number | 1438-30-8 |
|---|---|
| SMILES | CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NCCC(=N)N)C)NC(=O)CN=C(N)N |
| InChIKey | IDBIFFKSXLYUOT-UHFFFAOYSA-N |
📖 Product Overview
Netropsin (CAS: 1438-30-8) is a chemical compound with molecular formula C18H26N10O3 and molecular weight 430.5 g/mol. Its IUPAC systematic name is N-[5-[(3-amino-3-iminopropyl)carbamoyl]-1-methylpyrrol-3-yl]-4-[[2-(diaminomethylideneamino)acetyl]amino]-1-methylpyrrole-2-carboxamide.
IDBIFFKSXLYUOT-UHFFFAOYSA-N.
SMILES: CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NCCC(=N)N)C)NC(=O)CN=C(N)N.
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