n-{2-[2-(4-Amino-2,6,7-trimethyl-imidazo[4,5-c]pyridin-1-yl)-ethoxy]-ethyl}-c-(7,7-dimethyl-2-oxo-bicyclo[2.2.1]hept-1-yl)methanesulfonamide (HCID 21913450)

기본 정보

표준 SMILES: Cc1nc(N)c2nc(C)n(CCOCCNS(=O)(=O)CC34CCC(CC3=O)C4(C)C)c2c1C
InChIKey: XVKSAMIKTMQBRJ-UHFFFAOYSA-N
분자식: C23H35N5O4S
평균 분자량: 477.6 g/mol
단동위원소 질량: 477.24097579

이름 및 식별자

우선 이름: n-{2-[2-(4-Amino-2,6,7-trimethyl-imidazo[4,5-c]pyridin-1-yl)-ethoxy]-ethyl}-c-(7,7-dimethyl-2-oxo-bicyclo[2.2.1]hept-1-yl)methanesulfonamide
IUPAC: N-[2-[2-(4-amino-2,6,7-trimethylimidazo[4,5-c]pyridin-1-yl)ethoxy]ethyl]-1-(7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl)methanesulfonamide

이름 및 동의어

SCHEMBL4876925XVKSAMIKTMQBRJ-UHFFFAOYSA-Nn-{2-[2-(4-amino-2,6,7-trimethyl-imidazo[4,5 -c]pyridin-1-yl)-ethoxy]-ethyl}-c-(7,7-dimethyl-2-oxo-bicyclo[2.2.1]hept-1-yl)methanesulfonamiden-{2-[2-(4-amino-2,6,7-trimethyl-imidazo[4,5-c]pyridin-1-yl)-ethoxy]-ethyl}-c-(7,7-dimethyl-2-oxo-bicyclo[2.2.1]hept-1-yl)methanesulfonamide

데이터베이스 식별자

PubChem CID: 21913450

물성

구조 계산 물성

XLogP: 1.5
극성 표면적: 138 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 8
회전 가능 결합 수: 9
무거운 원자 수: 33
형식 전하: 0
복잡도: 846

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