Ethyl 2-(2-(2-imino-4-oxothiazolidin-5-yl)acetamido)-4,5-dimethylthiophene-3-carboxylate (HCID 2878630)

기본 정보

표준 SMILES: CCOC(=O)c1c(NC(=O)CC2SC(N)=NC2=O)sc(C)c1C
InChIKey: BDVUQICGEYYKJS-UHFFFAOYSA-N
분자식: C14H17N3O4S2
평균 분자량: 355.4 g/mol

이름 및 식별자

우선 이름: Ethyl 2-(2-(2-imino-4-oxothiazolidin-5-yl)acetamido)-4,5-dimethylthiophene-3-carboxylate
IUPAC: ethyl 2-[[2-(2-amino-4-oxo-1,3-thiazol-5-yl)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate

이름 및 동의어

302804-57-5ethyl 2-(2-(2-imino-4-oxothiazolidin-5-yl)acetamido)-4,5-dimethylthiophene-3-carboxylatesFRP-1 inhibitor-1CBMicro_038927ethyl 2-[[2-(2-amino-4-oxo-1,3-thiazol-5-yl)acetyl]amino]-4,5-dimethylthiophene-3-carboxylateMLS000688637BDVUQICGEYYKJS-UHFFFAOYSA-NGLXC-07219HMS2600H03STK951594AKOS016318672SMR000284523

이름 더 보기

BIM-0038784.P001EU-0046076ST50272533SR-01000500017SR-01000500017-1F1065-0475ethyl 2-[2-(2-imino-4-oxo(1,3-thiazolidin-5-yl))acetylamino]-4,5-dimethylthiop hene-3-carboxylateEthyl 2-{[(2-amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl) acetyl]amino}-4,5-dimethylthiophene-3-carboxylate

데이터베이스 식별자

PubChem CID: 2878630

물성

구조 계산 물성

XLogP: 2.1
극성 표면적: 164 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 6
회전 가능 결합 수: 6
무거운 원자 수: 23
형식 전하: 0
복잡도: 540

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