Basic information
- CAS
2716-79-2- Standard SMILES
COc1cc(NP(=O)(N2CC2)N2CC2)nc(OC)n1- InChIKey
KXAVRWZATBENFO-UHFFFAOYSA-N- Molecular formula
- C10H16N5O3P
- Average molar mass
- 285.24 g/mol
- Monoisotopic mass
- 285.09907639
Names & identifiers
- Preferred name
- Phosphinic amide, P,P-bis(1-aziridinyl)-N-(2,6-dimethoxy-4-pyrimidinyl)-
- IUPAC
- N-[bis(aziridin-1-yl)phosphoryl]-2,6-dimethoxypyrimidin-4-amine
Names & synonyms
BRN 06875692716-79-2Phosphinic amide, P,P-bis(1-aziridinyl)-N-(2,6-dimethoxy-4-pyrimidinyl)-DTXSID50181631P,P-Bis(1-aziridinyl)-N-(2,6-dimethoxy-4-pyrimidinyl)phosphinic amideRefChem:370255DTXCID90104122P,P-Bis(aziridin-1-yl)-N-(2,6-dimethoxypyrimidin-4-yl)phosphinic amide
Database identifiers
- CAS
2716-79-2- PubChem CID
- 200784
- DTXSID
DTXSID50181631
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 79.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 360
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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