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Substance Name: 1,5(6H)-Pyrimidinedicarboxylic acid, 2,4-dimethyl-6-(2-nitrophenyl)-, 5-(cyclopropylmethyl)1-(2-((phenylmethyl)(3-phenylpropyl)amino)ethyl) ester
RN: 117049-70-4
InChIKey: LDCLTFJZARIIDB-UHFFFAOYSA-N
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C36-H40-N4-O6
Molecular Weight
- 624.734
Names and Synonyms
- 1,5(6H)-Pyrimidinedicarboxylic acid, 2,4-dimethyl-6-(2-nitrophenyl)-, 5-(cyclopropylmethyl)1-(2-((phenylmethyl)(3-phenylpropyl)amino)ethyl) ester
Registry Numbers
CAS Registry Number
- 117049-70-4
System Generated Number
- 0117049704
Structure Descriptors
InChI
1S/C36H40N4O6/c1-26-33(35(41)46-25-30-19-20-30)34(31-17-9-10-18-32(31)39(44)45)40(36(42)43,27(2)37-26)23-22-38(24-29-14-7-4-8-15-29)21-11-16-28-12-5-3-6-13-28/h3-10,12-15,17-18,30H,11,16,19-25H2,1-2H3,(H,42,43)InChIKey
LDCLTFJZARIIDB-UHFFFAOYSA-NSmiles
CC1=C(C(=N(C(=N1)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 180mg/kg (180mg/kg) | United States Patent Document. Vol. #4772602, | |
mouse | LD50 | oral | > 1gm/kg (1000mg/kg) | United States Patent Document. Vol. #4772602, |