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1-cyclohexyl-3-[(E)-{[3-methoxy-4-(2-phenoxyethoxy)phenyl]methylidene}amino]urea

1-cyclohexyl-3-[(E)-{[3-methoxy-4-(2-phenoxyethoxy)phenyl]methylidene}amino]urea

Formula: C23H29N3O4

SMILES: COC1=CC(C=NNC(=O)NC2CCCCC2)=CC=C1OCCOC1=CC=CC=C1

IUPAC: 1-cyclohexyl-3-[(E)-{[3-methoxy-4-(2-phenoxyethoxy)phenyl]methylidene}amino]urea

InChI: InChI=1S/C23H29N3O4/c1-28-22-16-18(17-24-26-23(27)25-19-8-4-2-5-9-19)12-13-21(22)30-15-14-29-20-10-6-3-7-11-20/h3,6-7,10-13,16-17,19H,2,4-5,8-9,14-15H2,1H3,(H2,25,26,27)/b24-17+

Composition: C (67.13%), H (7.10%), N (10.21%), O (15.55%)

Molar Mass: 411.502

Atom Count: 59

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 411.215806426
Formal Charge 0
FSP3 0.39
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey KXJSUXWLSSTRAM-JJIBRWJFSA-N
Lipinski's Rule of Five 1
Molar Refractivity 115.63
Topological Polar Surface Area 81.18
Polarizability 44.55
Ring Count 3
Rotatable Bond Count 9

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H29N3O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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