Basic information
- CAS
92891-93-5- Standard SMILES
CC(NC(=O)N(CCCl)N=O)C(N)=O- InChIKey
UKTDZTRUMWTDID-UHFFFAOYSA-N- Molecular formula
- C6H11ClN4O3
- Average molar mass
- 222.63 g/mol
- Monoisotopic mass
- 222.0519679
Overview
structure given in first source
Names & identifiers
- Preferred name
- N-Chlorothylnitrosourea sarcosinamide
- IUPAC
- 2-[[2-chloroethyl(nitroso)carbamoyl]amino]propanamide
- English name
- 2-((((2-chloroethyl)nitrosoamino)carbonyl)amino)propanamide
- Molecular weight
- 0
Names & synonyms
N-Chlorothylnitrosourea sarcosinamide92891-93-52-((((2-Chloroethyl)nitrosoamino)carbonyl)amino)propanamideDTXSID10869105RefChem:927090DTXCID20817132Propanamide, 2-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-CHEMBL168220NS00125705N~2~-[(2-Chloroethyl)(nitroso)carbamoyl]alaninamide
Database identifiers
- CAS
92891-93-5- PubChem CID
- 108142
- DTXSID
DTXSID10869105- ChEMBL
CHEMBL168220
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 235
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationSubstances that inhibit or prevent the proliferation of NEOPLASMS.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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