6-benzoyl-4-cyclohexyl-8-thia-4,6-diazatricyclo[7.4.0.0²,?]trideca-1(9),2(7)-diene

6-benzoyl-4-cyclohexyl-8-thia-4,6-diazatricyclo[7.4.0.0²,?]trideca-1(9),2(7)-diene

Formula: C23H28N2OS

SMILES: O=C(N1CN(CC2=C1SC1=C2CCCC1)C1CCCCC1)C1=CC=CC=C1

IUPAC: 6-benzoyl-4-cyclohexyl-8-thia-4,6-diazatricyclo[7.4.0.0²,?]trideca-1(9),2(7)-diene

InChI: InChI=1S/C23H28N2OS/c26-22(17-9-3-1-4-10-17)25-16-24(18-11-5-2-6-12-18)15-20-19-13-7-8-14-21(19)27-23(20)25/h1,3-4,9-10,18H,2,5-8,11-16H2

Composition: C (72.59%), H (7.42%), N (7.36%), O (4.20%), S (8.42%)

Molar Mass: 380.55

Atom Count: 55

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	380.192234704
Formal Charge	0
FSP3	0.52
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	MMBOSBNWBRCMAA-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	110.79
Topological Polar Surface Area	23.55
Polarizability	42.87
Ring Count	5
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H28N2OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00