3-hydrazinyl-8-thia-4,6-diazatricyclo[7.4.0.0²,?]trideca-1(9),2,4,6-tetraene

3-hydrazinyl-8-thia-4,6-diazatricyclo[7.4.0.0²,?]trideca-1(9),2,4,6-tetraene

CAS: 40106-45-4

Formula: C10H12N4S

SMILES: NNC1=C2C3=C(CCCC3)SC2=NC=N1

IUPAC: 3-hydrazinyl-8-thia-4,6-diazatricyclo[7.4.0.0²,?]trideca-1(9),2,4,6-tetraene

InChI: InChI=1S/C10H12N4S/c11-14-9-8-6-3-1-2-4-7(6)15-10(8)13-5-12-9/h5H,1-4,11H2,(H,12,13,14)

Composition: C (54.52%), H (5.49%), N (25.43%), S (14.55%)

Molar Mass: 220.29

Atom Count: 27

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	220.078267576
Formal Charge	0
FSP3	0.4
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	RLYKRTXCPRRQST-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.46
Topological Polar Surface Area	63.83
Polarizability	23.09
Ring Count	3
Rotatable Bond Count	1

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