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3',5'-bis[4-(hydrazinecarbonyl)-3-propoxyphenyl]-3-propoxy-[1,1'-biphenyl]-4-carbohydrazide

3',5'-bis[4-(hydrazinecarbonyl)-3-propoxyphenyl]-3-propoxy-[1,1'-biphenyl]-4-carbohydrazide

Formula: C36H42N6O6

SMILES: CCCOC1=C(C=CC(=C1)C1=CC(=CC(=C1)C1=CC(OCCC)=C(C=C1)C(=O)NN)C1=CC(OCCC)=C(C=C1)C(=O)NN)C(=O)NN

IUPAC: 3',5'-bis[4-(hydrazinecarbonyl)-3-propoxyphenyl]-3-propoxy-[1,1'-biphenyl]-4-carbohydrazide

InChI: InChI=1S/C36H42N6O6/c1-4-13-46-31-19-22(7-10-28(31)34(43)40-37)25-16-26(23-8-11-29(35(44)41-38)32(20-23)47-14-5-2)18-27(17-25)24-9-12-30(36(45)42-39)33(21-24)48-15-6-3/h7-12,16-21H,4-6,13-15,37-39H2,1-3H3,(H,40,43)(H,41,44)(H,42,45)

Composition: C (66.04%), H (6.47%), N (12.84%), O (14.66%)

Molar Mass: 654.768

Atom Count: 90

Heavy Atom Count: 48

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 654.316583096
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 9
Hydrogen Bond Donor Count 6
InChIKey HWRNDPPRWVNCQH-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 189.36
Topological Polar Surface Area 193.05
Polarizability 74.55
Ring Count 4
Rotatable Bond Count 15

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