Text Search
Structure Search

5-[(3-ethoxy-4-{2-[4-(hexyloxy)phenoxy]ethoxy}phenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione

5-[(3-ethoxy-4-{2-[4-(hexyloxy)phenoxy]ethoxy}phenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione

Formula: C29H36N2O7

SMILES: CCCCCCOC1=CC=C(OCCOC2=CC=C(C=C3C(=O)N(C)C(=O)N(C)C3=O)C=C2OCC)C=C1

IUPAC: 5-[(3-ethoxy-4-{2-[4-(hexyloxy)phenoxy]ethoxy}phenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C29H36N2O7/c1-5-7-8-9-16-36-22-11-13-23(14-12-22)37-17-18-38-25-15-10-21(20-26(25)35-6-2)19-24-27(32)30(3)29(34)31(4)28(24)33/h10-15,19-20H,5-9,16-18H2,1-4H3

Composition: C (66.40%), H (6.92%), N (5.34%), O (21.35%)

Molar Mass: 524.614

Atom Count: 74

Heavy Atom Count: 38

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 524.252251507
Formal Charge 0
FSP3 0.41
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 0
InChIKey YEGHVOUETJYHPJ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 143.68
Topological Polar Surface Area 94.61
Polarizability 55.47
Ring Count 3
Rotatable Bond Count 14

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C29H36N2O7 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote