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Substance Name: Urea, N-(2,6-bis(1-methylethyl)phenyl)-N'-((1-(1-(phenylmethyl)-1H-indol-3-yl)cyclopentyl)methyl)-
RN: 145131-21-1
InChIKey: PMRFAWFYLZOOHW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C34-H41-N3-O

Molecular Weight

  • 507.7179
 
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Names and Synonyms

Synonym

  • N(sup 1)-(1-(1-Benzyl-3-indolyl)cyclopentylmethyl)-N(sup 2)-(2,6-diisopropylphenyl)urea

Systematic Name

  • Urea, N-(2,6-bis(1-methylethyl)phenyl)-N'-((1-(1-(phenylmethyl)-1H-indol-3-yl)cyclopentyl)methyl)-

Registry Numbers

CAS Registry Number

  • 145131-21-1

System Generated Number

  • 0145131211

Structure Descriptors

InChI

1S/C34H41N3O/c1-24(2)27-16-12-17-28(25(3)4)32(27)36-33(38)35-23-34(19-10-11-20-34)30-22-37(21-26-13-6-5-7-14-26)31-18-9-8-15-29(30)31/h5-9,12-18,22,24-25H,10-11,19-21,23H2,1-4H3,(H2,35,36,38)

InChIKey

PMRFAWFYLZOOHW-UHFFFAOYSA-N

Smiles

CC(C)c1cccc(c1NC(=O)NCC2(CCCC2)c3cn(c4c3cccc4)Cc5ccccc5)C(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 3200mg/kg (3200mg/kg)   United States Patent Document. Vol. #5219859,
rat LD oral > 3200mg/kg (3200mg/kg)   United States Patent Document. Vol. #5219859,