N-(2-Benzothiazolyl)-N',N'-dimethylurea
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Basic information
- CAS
34365-21-4- Standard SMILES
CN(C)C(=O)Nc1nc2ccccc2s1- InChIKey
AMIJSEIHRANBNZ-UHFFFAOYSA-N- Molecular formula
- C10H11N3OS
- Average molar mass
- 221.28 g/mol
- Monoisotopic mass
- 221.06228316
Names & identifiers
- Preferred name
- N-(2-Benzothiazolyl)-N',N'-dimethylurea
- IUPAC
- 3-(1,3-benzothiazol-2-yl)-1,1-dimethylurea
- English name
- Urea, N-2-benzothiazolyl-N,N-dimethyl- (9CI)
- Molecular formula
- C10H11N3OS
- Molecular weight
- 0
Names & synonyms
34365-21-4Urea, 3-(2-benzothiazolyl)-1,1-dimethyl-Urea, N'-2-benzothiazolyl-N,N-dimethyl-K6ESQ0C525NSC-190395N-(2-Benzothiazolyl)-N',N'-dimethylureaDTXSID70187938RefChem:1090966DTXCID301104293-(2-Benzothiazolyl)-1,1-dimethylureaN'-(1,3-benzothiazol-2-yl)-N,N-dimethylurea3-(1,3-benzothiazol-2-yl)-1,1-dimethylurea
Show more names
3-(Benzothiazol-2-yl)-1,1-dimethylurea
NSC 190395BRN 0384283NSC190395UNII-K6ESQ0C525SCHEMBL9467895SCHEMBL11368473SCHEMBL11468520AMIJSEIHRANBNZ-UHFFFAOYSA-N
Database identifiers
- CAS
34365-21-4- PubChem CID
- 99155
- DTXSID
DTXSID70187938- UNII
- K6ESQ0C525
- Nikkaji
- J49.068G
Properties
Computed structural propertiesFilling in
- XLogP
- 1.8
- Topological polar surface area
- 73.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 247
Physicochemical properties
- FDA UNII
- 6 ESQ0C525 · K6ESQ0C525
Related reactions
2 records
Compound notes
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