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4-[(2E)-2-({3-[(2,4-dichlorophenyl)methoxy]phenyl}methylidene)hydrazin-1-yl]-2,6-bis(pyrrolidin-1-yl)pyrimidine

4-[(2E)-2-({3-[(2,4-dichlorophenyl)methoxy]phenyl}methylidene)hydrazin-1-yl]-2,6-bis(pyrrolidin-1-yl)pyrimidine

Formula: C26H28Cl2N6O

SMILES: ClC1=CC=C(COC2=CC=CC(C=NNC3=CC(=NC(=N3)N3CCCC3)N3CCCC3)=C2)C(Cl)=C1

IUPAC: 4-[(2E)-2-({3-[(2,4-dichlorophenyl)methoxy]phenyl}methylidene)hydrazin-1-yl]-2,6-bis(pyrrolidin-1-yl)pyrimidine

InChI: InChI=1S/C26H28Cl2N6O/c27-21-9-8-20(23(28)15-21)18-35-22-7-5-6-19(14-22)17-29-32-24-16-25(33-10-1-2-11-33)31-26(30-24)34-12-3-4-13-34/h5-9,14-17H,1-4,10-13,18H2,(H,30,31,32)/b29-17+

Composition: C (61.06%), H (5.52%), Cl (13.86%), N (16.43%), O (3.13%)

Molar Mass: 511.45

Atom Count: 63

Heavy Atom Count: 35

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 510.1701649
Formal Charge 0
FSP3 0.35
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 1
InChIKey VUQQENSLZVIBOM-STBIYBPSSA-N
Lipinski's Rule of Five
Molar Refractivity 146.24
Topological Polar Surface Area 65.88
Polarizability 53.23
Ring Count 5
Rotatable Bond Count 8

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C26H28Cl2N6O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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