Name: Name:5-methyl-N-(propan-2-yl)-1,3,4-thiadiazol-2-amine
Brand: Angene
SKU: AG01BE7P
Rating: 90 (10 reviews)

5-methyl-N-(propan-2-yl)-1,3,4-thiadiazol-2-amine

CAS No.:

62347-23-3

Catalog Number:

AG01BE7P

Molecular Formula:

C6H11N3S

Molecular Weight:

157.2366

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Product Description

Catalog Number:

AG01BE7P

Chemical Name:

5-methyl-N-(propan-2-yl)-1,3,4-thiadiazol-2-amine

CAS Number:

62347-23-3

Molecular Formula:

C6H11N3S

Molecular Weight:

157.2366

MDL Number:

MFCD00124189

IUPAC Name:

5-methyl-N-propan-2-yl-1,3,4-thiadiazol-2-amine

InChI:

InChI=1S/C6H11N3S/c1-4(2)7-6-9-8-5(3)10-6/h4H,1-3H3,(H,7,9)

InChI Key:

LJRUOAZKZFJJIJ-UHFFFAOYSA-N

SMILES:

CC(Nc1nnc(s1)C)C

Properties

Complexity:

107

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

157.067g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

157.235g/mol

Monoisotopic Mass:

157.067g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101