2-(((p-(Bis(2-chloroethyl)amino)phenyl)imino)methyl)indol-3-ol
Basic information
- CAS
101651-84-7- Standard SMILES
Oc1c(C=Nc2ccc(N(CCCl)CCCl)cc2)[nH]c2ccccc12- InChIKey
RSQRWOWBGMDPOS-UHFFFAOYSA-N- Molecular formula
- C19H19Cl2N3O
- Average molar mass
- 376.3 g/mol
- Monoisotopic mass
- 375.0905176
Names & identifiers
- Preferred name
- 2-(((p-(Bis(2-chloroethyl)amino)phenyl)imino)methyl)indol-3-ol
- IUPAC
- 2-[[4-[bis(2-chloroethyl)amino]phenyl]iminomethyl]-1H-indol-3-ol
Names & synonyms
NIOSH/NL5160400NL516040002-(N-(p-(N,N-Bis(2-chloroethyl))aminophenyl)formimidoyl)-3-hydroxyindoleIndole, 2-(N-(p-(N,N-bis(2-chloroethyl))aminophenyl)formimidoyl)-3-hydroxy-2-(((p-(Bis(2-chloroethyl)amino)phenyl)imino)methyl)indol-3-olINDOL-3-OL, 2-(((p-(BIS(2-CHLOROETHYL)AMINO)PHENYL)IMINO)METHYL)-101651-84-7
Database identifiers
- CAS
101651-84-7- PubChem CID
- 58654
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 423
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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