1H-Indole-2,3-dione, 1-((bis(2-chloroethyl)amino)methyl)-5-chloro-
Basic information
- CAS
73763-37-8- Standard SMILES
O=C1C(=O)N(CN(CCCl)CCCl)c2ccc(Cl)cc21- InChIKey
IWPUQIPKQYZITR-UHFFFAOYSA-N- Molecular formula
- C13H13Cl3N2O2
- Average molar mass
- 335.6 g/mol
- Monoisotopic mass
- 334.004261
Names & identifiers
- Preferred name
- 1H-Indole-2,3-dione, 1-((bis(2-chloroethyl)amino)methyl)-5-chloro-
- IUPAC
- 1-[bis(2-chloroethyl)aminomethyl]-5-chloroindole-2,3-dione
Names & synonyms
1H-Indole-2,3-dione, 1-((bis(2-chloroethyl)amino)methyl)-5-chloro-73763-37-81-((Bis(2-chloroethyl)amino)methyl)-5-chloro-1H-indole-2,3-dione1-{[Bis(2-chloroethyl)amino]methyl}-5-chloro-1H-indole-2,3-dione1-(Bis(2-chloroethyl)amino)methyl-5-chloroisatinDTXSID90224117
Database identifiers
- CAS
73763-37-8- PubChem CID
- 153455
- DTXSID
DTXSID90224117
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 40.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 375
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Compound notes
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