N-(6-methoxy-1,3-benzothiazol-2-yl)guanidine
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Basic information
- Standard SMILES
COc1ccc2nc(NC(=N)N)sc2c1- InChIKey
JQHGAVRMSKHICJ-UHFFFAOYSA-N- Molecular formula
- C9H10N4OS
- Average molar mass
- 222.27 g/mol
- Monoisotopic mass
- 222.05753213
Names & identifiers
- Preferred name
- N-(6-methoxy-1,3-benzothiazol-2-yl)guanidine
- IUPAC
- 2-(6-methoxy-1,3-benzothiazol-2-yl)guanidine
Names & synonyms
86328-45-2N-(6-methoxy-1,3-benzothiazol-2-yl)guanidine1-(6-Methoxybenzo[d]thiazol-2-yl)guanidineMFCD223749712-(6-methoxy-1,3-benzothiazol-2-yl)guanidineguanidine, N-(6-methoxy-2-benzothiazolyl)-Guanidine, (6-methoxy-2-benzothiazolyl)- (9CI)SCHEMBL10804473SCHEMBL10804483JQHGAVRMSKHICJ-UHFFFAOYSA-N6-Methoxybenzothiazol-2-ylguanidineALBB-022130
Show more names
STL582126AKOS015997420LS-06863CS-03579091-(6-methoxy-1,3-benzothiazol-2-yl)guanidineH33448
Database identifiers
- PubChem CID
- 13150313
Properties
Computed structural propertiesFilling in
- XLogP
- 1.6
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 256
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Related reactions
1 records
Compound notes
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