Tert-butyl (tert-butoxycarbonyl{6-[(pyridin-3-ylsulfonyl)aminomethyl]pyridin-2-yl}amino)acetate

HCID 86651773

기본 정보

표준 SMILES
CC(C)(C)OC(=O)CN(C(=O)OC(C)(C)C)c1cccc(CNS(=O)(=O)c2cccnc2)n1
InChIKey
NLMQBMMHAQKIEK-UHFFFAOYSA-N
분자식
C22H30N4O6S
평균 분자량
478.6 g/mol

이름 및 식별자

우선 이름
Tert-butyl (tert-butoxycarbonyl{6-[(pyridin-3-ylsulfonyl)aminomethyl]pyridin-2-yl}amino)acetate
IUPAC
tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonyl-[6-[(pyridin-3-ylsulfonylamino)methyl]-2-pyridinyl]amino]acetate

이름 및 동의어

TQR0414NLMQBMMHAQKIEK-UHFFFAOYSA-Ntert-butyl (tert-butoxycarbonyl {6-[(pyridin-3-ylsulfonyl)aminomethyl]pyridin-2-yl}-amino)acetatetert-butyl (tert-butoxycarbonyl {6-[(pyridin-3-ylsulfonyl)aminomethyl]pyridin-2-yl}amino)-acetatetert-Butyl (tert-butoxycarbonyl {6-[(pyridin-3-ylsulfonyl)aminomethyl]pyridin-2-yl}amino)acetatetert-Butyl (tert-butoxycarbonyl{6-[(pyridin-3-ylsulfonyl)aminomethyl]-pyridin-2-yl}amino)acetatetert-butyl (tert-butoxycarbonyl{6-[(pyridin-3-ylsulfonyl)aminomethyl]pyridin-2-yl}-amino)acetatetert-butyl (tert-butoxycarbonyl{6-[(pyridin-3-ylsulfonyl)aminomethyl]pyridin-2-yl}amino)acetatetert-butyl 2-((tert-butoxycarbonyl)(6-((pyridine-3-sulfonamido)methyl)pyridin-2-yl)amino)acetatetert-butyl(tert-butoxycarbonyl{6-[(pyridin-3-ylsulfonyl)aminomethyl]pyridin-2-yl}-amino)acetatetert-butyl(tert-butoxycarbonyl{6-[(pyridin-3-ylsulfonyl)aminomethyl]pyridin-2-yl}amino)acetate

데이터베이스 식별자

PubChem CID
86651773

물성

구조 계산 물성

XLogP
2.3
극성 표면적
136 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
9
회전 가능 결합 수
11
무거운 원자 수
33

관련 반응

14건

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