Carbamic acid, (1-amino-2-(4-thiazolyl)-1H-benzimidazol-6-yl)-, 1-methylethyl ester

HCID 148484

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Basic information

CAS: 49628-54-8
Standard SMILES: CC(C)OC(=O)Nc1ccc2nc(-c3cscn3)n(N)c2c1
InChIKey: DPHOIGMYYWNANO-UHFFFAOYSA-N
Molecular formula: C14H15N5O2S
Average molar mass: 317.37 g/mol
Monoisotopic mass: 317.09464591

Names & identifiers

Preferred name: Carbamic acid, (1-amino-2-(4-thiazolyl)-1H-benzimidazol-6-yl)-, 1-methylethyl ester
IUPAC: propan-2-yl N-[3-amino-2-(1,3-thiazol-4-yl)benzimidazol-5-yl]carbamate

Names & synonyms

Carbamic acid, (1-amino-2-(4-thiazolyl)-1H-benzimidazol-6-yl)-, 1-methylethyl ester49628-54-81-Methylethyl (1-amino-2-(4-thiazolyl)-1H-benzimidazol-6-yl)carbamateDTXSID40197943Propan-2-yl [1-amino-2-(1,3-thiazol-4-yl)-1H-1,3-benzimidazol-6-yl]carbamate

Database identifiers

CAS: 49628-54-8
PubChem CID: 148484
DTXSID: DTXSID40197943

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 123 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 4
Heavy atoms: 22
Formal charge: 0
Complexity: 411

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