Benzenamine, N,N-bis(2-chloroethyl)-4-(5-((5-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl)methyl)-1H-benzimidazol-2-yl)-
Basic information
- CAS
166546-20-9- Standard SMILES
CN1CCN(c2ccc3nc(Cc4ccc5nc(-c6ccc(N(CCCl)CCCl)cc6)[nH]c5c4)[nH]c3c2)CC1- InChIKey
RCSQPIRTROVFNF-UHFFFAOYSA-N- Molecular formula
- C30H33Cl2N7
- Average molar mass
- 562.5 g/mol
- Monoisotopic mass
- 561.2174495
Names & identifiers
- Preferred name
- Benzenamine, N,N-bis(2-chloroethyl)-4-(5-((5-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl)methyl)-1H-benzimidazol-2-yl)-
- IUPAC
- N,N-bis(2-chloroethyl)-4-[6-[[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]methyl]-1H-benzimidazol-2-yl]aniline
Names & synonyms
166546-20-9Benzenamine, N,N-bis(2-chloroethyl)-4-(5-((5-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl)methyl)-1H-benzimidazol-2-yl)-CCRIS 8392Benzenamine, N,N-bis(2-chloroethyl)-4-[5-[[5-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]methyl]-1H-benzimidazol-2-yl]-ZML82D2FY8N,N-Bis(2-chloroethyl)-4-(5-((5(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl)methyl)-1H-benzimidazol-2-yl)benzenamineDTXSID50168124Benzenamine, N,N-bis(2-chloroethyl)-4-[6-[[6-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]methyl]-1H-benzimidazol-2-yl]-N,N-BIS(2-CHLOROETHYL)-4-(5-((5-(4-METHYL-1-PIPERAZINYL)-1H-BENZIMIDAZOL-2-YL)METHYL)-1H-BENZIMIDAZO L-2-YL)-BENZENAMINEN,N-Bis(2-chloroethyl)-4-(6-{[6-(4-methylpiperazin-1-yl)-1H-1,3-benzimidazol-2-yl]methyl}-1H-1,3-benzimidazol-2-yl)anilineN,N-Bis(2-chloroethyl)-4-[6-[[6-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]methyl]-1H-benzimidazol-2-yl]benzenamine
Database identifiers
- CAS
166546-20-9- PubChem CID
- 154803
- DTXSID
DTXSID50168124- UNII
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 67.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 754
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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