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

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

Formula: C24H31N3O4

SMILES: CCOC1=CC(C=NNC(=O)NC2CCCCC2)=CC=C1OCCOC1=CC=CC=C1

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

InChI: InChI=1S/C24H31N3O4/c1-2-29-23-17-19(18-25-27-24(28)26-20-9-5-3-6-10-20)13-14-22(23)31-16-15-30-21-11-7-4-8-12-21/h4,7-8,11-14,17-18,20H,2-3,5-6,9-10,15-16H2,1H3,(H2,26,27,28)/b25-18+

Composition: C (67.74%), H (7.34%), N (9.88%), O (15.04%)

Molar Mass: 425.529

Atom Count: 62

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 425.23145649
Formal Charge 0
FSP3 0.42
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey QFIOKUSJTYOBFH-XIEYBQDHSA-N
Lipinski's Rule of Five 1
Molar Refractivity 120.38
Topological Polar Surface Area 81.18
Polarizability 46.38
Ring Count 3
Rotatable Bond Count 10

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C24H31N3O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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