5-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-amine

5-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-amine

CAS: 40045-50-9

Formula: C5H3N5O2S3

SMILES: NC1=NN=C(SC2=NC=C(S2)[N+]([O-])=O)S1

IUPAC: 5-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-amine

InChI: InChI=1S/C5H3N5O2S3/c6-3-8-9-5(14-3)15-4-7-1-2(13-4)10(11)12/h1H,(H2,6,8)

Composition: C (22.98%), H (1.16%), N (26.80%), O (12.25%), S (36.81%)

Molar Mass: 261.29

Atom Count: 18

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	260.944887879
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	NQQBNZBOOHHVQP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.88
Topological Polar Surface Area	107.83
Polarizability	21.13
Ring Count	2
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	CAS		UnitPrice
98%	<14 Days	40045-50-9		Quote Only

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
96%	<7 Days	40045-50-9		$53.82-$607.55$53.82$98.33$229.77$607.55

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
96%	<5 Days	40045-50-9		$317.77-$986.10$317.77$986.10

Molnova Chemicals

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<4 Days	40045-50-9		$43.57-$890.53$43.57$61.92$110.07$197.98$351.62$593.17$890.53