1,3-bis(4-methoxyphenyl)thiourea

1,3-bis(4-methoxyphenyl)thiourea

CAS: 1227-45-8

Formula: C15H16N2O2S

SMILES: COC1=CC=C(NC(=S)NC2=CC=C(OC)C=C2)C=C1

IUPAC: 1,3-bis(4-methoxyphenyl)thiourea

InChI: InChI=1S/C15H16N2O2S/c1-18-13-7-3-11(4-8-13)16-15(20)17-12-5-9-14(19-2)10-6-12/h3-10H,1-2H3,(H2,16,17,20)

Composition: C (62.48%), H (5.59%), N (9.71%), O (11.10%), S (11.12%)

Molar Mass: 288.37

Atom Count: 36

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	288.093248937
Formal Charge	0
FSP3	0.13
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	RGRJEERVXALLTH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	86.97
Topological Polar Surface Area	42.52
Polarizability	32.51
Ring Count	2
Rotatable Bond Count	4

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