tert-butyl 4-(1H-indol-5-yloxy)-5-methyl-5H-pyrrolo[3,4-d]pyrimidine-6(7H)-carboxylate

HCID 59394355

기본 정보

표준 SMILES
CC1c2c(ncnc2Oc2ccc3[nH]ccc3c2)CN1C(=O)OC(C)(C)C
InChIKey
DPGZTVKWVXMLDI-UHFFFAOYSA-N
분자식
C20H22N4O3
평균 분자량
366.4 g/mol

이름 및 식별자

우선 이름
tert-butyl 4-(1H-indol-5-yloxy)-5-methyl-5H-pyrrolo[3,4-d]pyrimidine-6(7H)-carboxylate
IUPAC
tert-butyl 4-(1H-indol-5-yloxy)-5-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxylate

이름 및 동의어

SCHEMBL2793128DPGZTVKWVXMLDI-UHFFFAOYSA-Ntert-butyl 4-(1H-indol-5-yloxy)-5-methyl-5H-pyrrolo[3,4-d]pyrimidine-6 (7H)-carboxylatetert-butyl 4-(1H-indol-5-yloxy)-5-methyl-5H-pyrrolo[3,4-d]pyrimidine-6(7 H)-carboxylatetert-butyl 4-(1H-indol-5-yloxy)-5-methyl-5H-pyrrolo[3,4-d]pyrimidine-6(7H)-carboxylate(+/-)-4-(1H-indol-5-yloxy)-5-methyl-5,7-dihydro-pyrrolo[3,4-d]pyrimidine-6-carboxylic acid tert-butyl ester4-(1H-Indol-5-yloxy)-5-methyl-5,7-dihydro-pyrrolo[3,4-d]pyrimidine-6-carboxylic acid tert-butyl ester

데이터베이스 식별자

PubChem CID
59394355

물성

구조 계산 물성

XLogP
2.9
극성 표면적
80.3 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
5
회전 가능 결합 수
4
무거운 원자 수
27

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19건

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