Basic information
- CAS
21383-85-7- Standard SMILES
Clc1nc(N2CC2)c2ncnc(N3CC3)c2n1- InChIKey
HKCAPPCAQXYFKE-UHFFFAOYSA-N- Molecular formula
- C10H9ClN6
- Average molar mass
- 248.67 g/mol
- Monoisotopic mass
- 248.057722
Names & identifiers
- Preferred name
- 4,8-Bis(aziridin-1-yl)-2-chloropyrimido[5,4-d]pyrimidine
- IUPAC
- 4,8-bis(aziridin-1-yl)-2-chloropyrimido[5,4-d]pyrimidine
Names & synonyms
21383-85-74,8-bis(aziridin-1-yl)-2-chloropyrimido[5,4-d]pyrimidineNSC525562DTXSID70326224NSC-525562
Database identifiers
- CAS
21383-85-7- PubChem CID
- 352249
- DTXSID
DTXSID70326224
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 307
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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