3-(2-Acetylamino-3-methyl-butyryl)-5-tert-butyl-2,3-dihydro-[1,2,4]thiadiazole-2-carboxylic Acid Ethyl Ester

HCID 68655348

기본 정보

표준 SMILES
CCOC(=O)N1SC(C(C)(C)C)=NC1C(=O)C(NC(C)=O)C(C)C
InChIKey
WADIVGOILNIUOU-UHFFFAOYSA-N
분자식
C16H27N3O4S
평균 분자량
357.5 g/mol

이름 및 식별자

우선 이름
3-(2-Acetylamino-3-methyl-butyryl)-5-tert-butyl-2,3-dihydro-[1,2,4]thiadiazole-2-carboxylic Acid Ethyl Ester
IUPAC
ethyl 3-(2-acetamido-3-methylbutanoyl)-5-tert-butyl-3H-1,2,4-thiadiazole-2-carboxylate

이름 및 동의어

SCHEMBL3470861WADIVGOILNIUOU-UHFFFAOYSA-N3-(2-Acetylamino-3-methyl-butyryl)-5-tert-butyl-2,3-dihydro-[1,2,4]thiadiazole-2-carboxylic Acid Ethyl Ester3-(2-Acetylamino-3-methylbutyryl)-5-tert-butyl-2,3-dihydro-[1,2,4] thiadiazole-2-carboxylic acid ethyl ester3-(2-Acetylamino-3-methylbutyryl)-5-tert-butyl-2,3-dihydro-[1,2,4]thiadiazole-2-carboxylic acid ethyl ester

데이터베이스 식별자

PubChem CID
68655348

물성

구조 계산 물성

XLogP
2.6
극성 표면적
113 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
6
회전 가능 결합 수
7
무거운 원자 수
24

관련 반응

4건

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