145131-32-4
N(SUP 1)-(2,6-DIISOPROPYLPHENYL)-N(SUP 2)-(1-(1-PHENYL-3-INDOLYL)CYCLO PENTYLMETHYL)UREA
NameN(SUP 1)-(2,6-DIISOPROPYLPHENYL)-N(SUP 2)-(1-(1-PHENYL-3-INDOLYL)CYCLO PENTYLMETHYL)UREA
1Identification
【Name】
N(SUP 1)-(2,6-DIISOPROPYLPHENYL)-N(SUP 2)-(1-(1-PHENYL-3-INDOLYL)CYCLO PENTYLMETHYL)UREA
【CAS】
【MDL】
MFCD01761413
【English Synonyms】
【Formula】
C33 H39 N3 O
【MolWeight】
493.691
【Inchi】
InChI=1S/C33H39N3O/c1-23(2)26-16-12-17-27(24(3)4)31(26)35-32(37)34-22-33(19-10-11-20-33)29-21-36(25-13-6-5-7-14-25)30-18-9-8-15-28(29)30/h5-9,12-18,21,23-24H,10-11,19-20,22H2,1-4H3,(H2,34,35,37)
【InChIKey】
InChIKey=BYLKFLVZRAZRBC-UHFFFAOYSA-N
【SMILES】
CC(C)c1cccc(c1NC(=O)NCC2(CCCC2)c3cn(c4c3cccc4)c5ccccc5)C(C)C
【MOL File】
N(SUP 1)-(2,6-DIISOP….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N(SUP 1)-(2,6-DIISOPROPYLPHENYL)-N(SUP 2)-(1-(1-PHENYL-3-INDOLYL)CYCLO PENTYLMETHYL)UREA.cml