Text Search
Structure Search

10-phenyl-7-thia-9,11-diazatricyclo[6.4.0.0²,?]dodeca-1(8),2(6)-dien-12-one

10-phenyl-7-thia-9,11-diazatricyclo[6.4.0.0²,?]dodeca-1(8),2(6)-dien-12-one

Formula: C15H14N2OS

SMILES: O=C1NC(NC2=C1C1=C(CCC1)S2)C1=CC=CC=C1

IUPAC: 10-phenyl-7-thia-9,11-diazatricyclo[6.4.0.0²,?]dodeca-1(8),2(6)-dien-12-one

InChI: InChI=1/C15H14N2OS/c18-14-12-10-7-4-8-11(10)19-15(12)17-13(16-14)9-5-2-1-3-6-9/h1-3,5-6,13,17H,4,7-8H2,(H,16,18)

Composition: C (66.64%), H (5.22%), N (10.36%), O (5.92%), S (11.86%)

Molar Mass: 270.35

Atom Count: 33

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 270.082684253
Formal Charge 0
FSP3 0.27
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey BHKAWTGNFPCIOC-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 76.69
Topological Polar Surface Area 41.13
Polarizability 28.3
Ring Count 4
Rotatable Bond Count 1

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C15H14N2OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote