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1,3-dibenzylthiourea

1,3-dibenzylthiourea

CAS: 1424-14-2

Formula: C15H16N2S

SMILES: S=C(NCC1=CC=CC=C1)NCC1=CC=CC=C1

IUPAC: 1,3-dibenzylthiourea

InChI: InChI=1S/C15H16N2S/c18-15(16-11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H2,16,17,18)

Composition: C (70.28%), H (6.29%), N (10.93%), S (12.51%)

Molar Mass: 256.37

Atom Count: 34

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 256.103419697
Formal Charge 0
FSP3 0.13
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 2
InChIKey LQZPSWMMTICWHD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 80.15
Topological Polar Surface Area 24.06
Polarizability 31.25
Ring Count 2
Rotatable Bond Count 4

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