N-(5-Methoxy-1,3,4-thiadiazol-2-yl)-1-propylhydrazine-1-carboxamide

HCID 21454627

Notes Reactions

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Basic information

CAS: 57773-88-3
Standard SMILES: CCCN(N)C(=O)Nc1nnc(OC)s1
InChIKey: PRBVROFOJRFSNN-UHFFFAOYSA-N
Molecular formula: C7H13N5O2S
Average molar mass: 231.28 g/mol
Monoisotopic mass: 231.07899585

Names & identifiers

Preferred name: N-(5-Methoxy-1,3,4-thiadiazol-2-yl)-1-propylhydrazine-1-carboxamide
IUPAC: 1-amino-3-(5-methoxy-1,3,4-thiadiazol-2-yl)-1-propylurea

Names & synonyms

57773-88-3N-(5-Methoxy-1,3,4-thiadiazol-2-yl)-1-propylhydrazinecarboxamideSCHEMBL11704450DTXSID80614200PRBVROFOJRFSNN-UHFFFAOYSA-NN-(5-Methoxy-1,3,4-thiadiazol-2-yl)-1-propylhydrazine-1-carboxamide2-Propyl-4-(5-methoxy-1,3,4-thiadiazol-2-yl)-semicarbazide2-propyl-4-(5-methoxy-1,3,4-thiadiazol-2-yl)semicarbazide

Database identifiers

CAS: 57773-88-3
PubChem CID: 21454627
DTXSID: DTXSID80614200

Properties

Computed structural properties

XLogP: 0.3
Topological polar surface area: 122 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 4
Heavy atoms: 15
Formal charge: 0
Complexity: 218

Related reactions

6 records

New reaction record

HRID 160752As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 435901As productuspto-grants-1977_02

HRID 435902As reactantuspto-grants-1977_02

HRID 1548607As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

HRID 1579476As productuspto-grants-1976_01

HRID 1579477As reactantuspto-grants-1976_01

Compound notes

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