2-Oxazolidinone, 3-(2-(4-(8-fluoro-2-methyl-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-1-piperazinyl)ethyl)-, (+-)-

HCID 3042509

기본 정보

CAS
59849-49-9
표준 SMILES
Cc1ccc2c(c1)CC(N1CCN(CCN3CCOC3=O)CC1)c1cc(F)ccc1S2
InChIKey
PUILADRSZIIQMY-UHFFFAOYSA-N
분자식
C24H28FN3O2S
평균 분자량
441.6 g/mol
단동위원소 질량
441.18862636

이름 및 식별자

우선 이름
2-Oxazolidinone, 3-(2-(4-(8-fluoro-2-methyl-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-1-piperazinyl)ethyl)-, (+-)-
IUPAC
3-[2-[4-(3-fluoro-8-methyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]ethyl]-1,3-oxazolidin-2-one

이름 및 동의어

59849-49-92-Oxazolidinone, 3-(2-(4-(8-fluoro-2-methyl-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-1-piperazinyl)ethyl)-, (+-)-RefChem:264617SCHEMBL11610695DTXSID80975247PUILADRSZIIQMY-UHFFFAOYSA-N3-{2-[4-(8-fluoro-10,11-dihydro-2-methyl-dibenzo [b,f]thiepin-10-yl)-1-piperazinyl]-ethyl}-2-oxazolidinone3-{2-[4-(8-Fluoro-2-methyl-10,11-dihydrodibenzo[b,f]thiepin-10-yl)piperazin-1-yl]ethyl}-1,3-oxazolidin-2-oneracemic 3-{2-[4-(8-fluoro-10,11-dihydro-2-methyl-dibenzo[b,f]thiepin-10-yl)-1-piperazinyl]-ethyl }-2-oxazolidinoneracemic 3-{2-[4-(8-fluoro-10,11-dihydro-2-methyl-dibenzo[b,f]thiepin-10-yl)-1-piperazinyl]-ethyl}-2-oxazolidinoneracemic 3-{2-[4-(8-fluoro-10,11-dihydro-2-methyldibenzo[b,f]thiepin-10-yl)-1-piperazinyl]-ethyl}-2-oxazolidinone

데이터베이스 식별자

CAS
59849-49-9
PubChem CID
3042509
DTXSID
DTXSID80975247

물성

구조 계산 물성

XLogP
3.8
극성 표면적
61.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
6
회전 가능 결합 수
4
무거운 원자 수
31

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