Tricyclo [3.3.1.13,7]dec-2-yl (+/-)-[1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-2-[[2-(2-thienyl)ethyl]amino]ethyl]carbamate

HCID 86747496

기본 정보

표준 SMILES
CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1cccs1
InChIKey
LYBKJUWATNCASS-UHFFFAOYSA-N
분자식
C29H35N3O3S
평균 분자량
505.7 g/mol

이름 및 식별자

우선 이름
Tricyclo [3.3.1.13,7]dec-2-yl (+/-)-[1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-2-[[2-(2-thienyl)ethyl]amino]ethyl]carbamate
IUPAC
2-adamantyl N-[3-(1H-indol-3-yl)-2-methyl-1-oxo-1-(2-thiophen-2-ylethylamino)propan-2-yl]carbamate

이름 및 동의어

LYBKJUWATNCASS-UHFFFAOYSA-NTricyclo [3.3.1.13,7 ]dec-2-yl (+/-)-[1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-2-[[2-(2-thienyl)ethyl]amino]ethyl]carbamateTricyclo[3.3.1.13,7 ]dec-2-yl (+/-)-[1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-2-[[2-(2-thienyl) ethyl]amino]ethyl]carbamateTricyclo[3.3.1.13,7 ]dec-2-yl (+/-)-[1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-2-[[2-(2-thienyl)ethyl]amino]ethyl]carbamateTricyclo[3.3.1.13,7 ]dec-2-yl (+/-)-[1-(1H-indol-3-ylmethyl)-1-methyl-2oxo-2-[[2-(2-thienyl)ethyl]amino]ethyl]carbamate

데이터베이스 식별자

PubChem CID
86747496

물성

구조 계산 물성

XLogP
5.7
극성 표면적
111 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
4
회전 가능 결합 수
9
무거운 원자 수
36

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5건

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