Text Search
Structure Search

5-(phenylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione

5-(phenylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione

Formula: C11H8N2O2S

SMILES: O=C1NC(=S)NC(=O)C1=CC1=CC=CC=C1

IUPAC: 5-(phenylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione

InChI: InChI=1S/C11H8N2O2S/c14-9-8(10(15)13-11(16)12-9)6-7-4-2-1-3-5-7/h1-6H,(H2,12,13,14,15,16)

Composition: C (56.89%), H (3.47%), N (12.06%), O (13.78%), S (13.80%)

Molar Mass: 232.26

Atom Count: 24

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 232.03064868
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey TXGVDOCEVWJSPR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.11
Topological Polar Surface Area 58.2
Polarizability 24.42
Ring Count 2
Rotatable Bond Count 1

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C11H8N2O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote