1-Ethyl-6-fluoro-1,4-dihydro-7-[3-(hydroxymethyl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid, hydrochloride (HCID 14839397)

기본 정보

표준 SMILES: CCn1cc(C(=O)O)c(=O)c2cc(F)c(N3CCNC(CO)C3)cc21.Cl
InChIKey: NUWOTXUQONLSLU-UHFFFAOYSA-N
분자식: C17H21ClFN3O4
평균 분자량: 385.8 g/mol

이름 및 식별자

우선 이름: 1-Ethyl-6-fluoro-1,4-dihydro-7-[3-(hydroxymethyl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid, hydrochloride
IUPAC: 1-ethyl-6-fluoro-7-[3-(hydroxymethyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid;hydrochloride

이름 및 동의어

CHEMBL1202531NUWOTXUQONLSLU-UHFFFAOYSA-N1-Ethyl-6-fluoro-1,4-dihydro-7-[3-(hydroxymethyl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid, hydrochloride1-Ethyl-6-fluoro-1,4-dihydro-7[3-(hydroxymethyl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid, hydrochloride

데이터베이스 식별자

PubChem CID: 14839397
ChEMBL: CHEMBL1202531

물성

구조 계산 물성

극성 표면적: 93.1 Å²
수소 결합 공여자 수: 4
수소 결합 수용자 수: 8
회전 가능 결합 수: 4
무거운 원자 수: 26
형식 전하: 0
복잡도: 570

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