tert-butyl (S)-6-(((S)-1,1-diethoxypropan-2-yl)(naphthalen-1-ylmethyl)amino)-5-(2-(1-methyl-2-(naphthalen-1-ylmethylcarbamoyl)hydrazinyl)acetamido)-6-oxohexylcarbamate (HCID 86698538)

기본 정보

표준 SMILES: CCOC(OCC)[C@H](C)N(Cc1cccc2ccccc12)C(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)CN(C)NC(=O)NCc1cccc2ccccc12
InChIKey: JSPFOTNWABMQQJ-PLGUFQJHSA-N
분자식: C44H60N6O7
평균 분자량: 785 g/mol

이름 및 식별자

우선 이름: tert-butyl (S)-6-(((S)-1,1-diethoxypropan-2-yl)(naphthalen-1-ylmethyl)amino)-5-(2-(1-methyl-2-(naphthalen-1-ylmethylcarbamoyl)hydrazinyl)acetamido)-6-oxohexylcarbamate
IUPAC: tert-butyl N-[(5S)-6-[[(2S)-1,1-diethoxypropan-2-yl]-(naphthalen-1-ylmethyl)amino]-5-[[2-[methyl-(naphthalen-1-ylmethylcarbamoylamino)amino]acetyl]amino]-6-oxohexyl]carbamate

이름 및 동의어

JSPFOTNWABMQQJ-PLGUFQJHSA-Ntert-butyl (S)-6-(((S)-1,1-diethoxypropan-2-yl)(naphthalen-1-ylmethyl)amino)-5-(2-(1-methyl-2-(naphthalen-1-ylmethylcarbamoyl)hydrazinyl)acetamido)-6-oxohexylcarbamatetert-butyl(S)-6-(((S)-1,1-diethoxypropan-2-yl)(naphthalen-1-ylmethyl)amino)-5-(2-(1-methyl-2-(naphthalen-1-ylmethylcarbamoyl)hydrazinyl)acetamido)-6-oxohexylcarbamate

데이터베이스 식별자

PubChem CID: 86698538

물성

구조 계산 물성

XLogP: 6.8
극성 표면적: 151 Å²
수소 결합 공여자 수: 4
수소 결합 수용자 수: 8
회전 가능 결합 수: 22
무거운 원자 수: 57
형식 전하: 0
복잡도: 1,240

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