7-Chloro-9-(4-methyl-piperazin-1-ylmethyl)-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-8-carbaldehyde
기본 정보
- 표준 SMILES
CN1CCN(Cc2c(C=O)c(Cl)nc3cc4c(cc23)OCCO4)CC1- InChIKey
SPOMOQUCJZFSQQ-UHFFFAOYSA-N- 분자식
- C18H20ClN3O3
- 평균 분자량
- 361.8 g/mol
이름 및 식별자
- 우선 이름
- 7-Chloro-9-(4-methyl-piperazin-1-ylmethyl)-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-8-carbaldehyde
- IUPAC
- 7-chloro-9-[(4-methylpiperazin-1-yl)methyl]-2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-8-carbaldehyde
이름 및 동의어
7-chloro-9-(4-methylpiperazin-1-ylmethyl)-2,3-dihydro-[1,4)dioxino[2,3-g]quinolin-8-carbaldehyde7-chloro-9-(4-methylpiperazin-1-ylmethyl)-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-8-carbaldehydeSCHEMBL6437103SPOMOQUCJZFSQQ-UHFFFAOYSA-N7-chloro-9-(4-methyl-piperazin-1-yl-methyl)-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-8-carbaldehyde7-chloro-9-(4-methyl-piperazin-1-ylmethyl)-2,3-dihydro-[1,4 ]dioxino [2,3-g]quinolin-8-carbaldehyde7-chloro-9-(4-methyl-piperazin-1-ylmethyl)-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-8-carbaldehyde
데이터베이스 식별자
- PubChem CID
- 22637078
물성
구조 계산 물성
- XLogP
- 2
- 극성 표면적
- 54.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 25
- 형식 전하
- 0
- 복잡도
- 474
관련 반응
13건
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