기본 정보
- CAS
185835-97-6- 표준 SMILES
COC[C@@H]1CN(c2noc3cc(OCCCC(F)(F)F)ccc23)C(=O)O1- InChIKey
SQMNCLANJWZZOG-NSHDSACASA-N- 분자식
- C16H17F3N2O5
- 평균 분자량
- 374.31 g/mol
- 단동위원소 질량
- 374.10895613
이름 및 식별자
- 우선 이름
- (5S)-5-(Methoxymethyl)-3-[6-(4,4,4-trifluorobutoxy)-1,2-benzoxazol-3-YL]-1,3-oxazolidin-2-one
- IUPAC
- (5S)-5-(methoxymethyl)-3-[6-(4,4,4-trifluorobutoxy)-1,2-benzoxazol-3-yl]-1,3-oxazolidin-2-one
- 영어명
- (5S)-5-(METHOXYMETHYL)-3-[6-(4,4,4-TRIFLUOROBUTOXY)-1,2-BENZOXAZOL-3-YL]-1,3-OXAZOLIDIN-2-ONE
- 분자식
- C16H17F3N2O5
- 분자량
- 374.31
이름 및 동의어
185835-97-6SL-25.1188(5S)-5-(METHOXYMETHYL)-3-[6-(4,4,4-TRIFLUOROBUTOXY)-1,2-BENZOXAZOL-3-YL]-1,3-OXAZOLIDIN-2-ONESL251188A8C48J5JCPUNII-A8C48J5JCPSL-251188CHEMBL3354977(5S)-5-(Methoxymethyl)-3-(6-(4,4,4-trifluorobutoxy)-1,2-benzisoxazol-3-yl)-2-oxazolidinone(S)-5-(methoxymethyl)-3-(6-(4,4,4-trifluorobutoxy)benzo[d]isoxazol-3-yl)oxazolidin-2-one2-Oxazolidinone, 5-(methoxymethyl)-3-(6-(4,4,4-trifluorobutoxy)-1,2-benzisoxazol-3-yl)-, (5S)-2-Oxazolidinone, 5-(methoxymethyl)-3-(6-(4,4,4-trifluorobutoxy)-1,2-benzisoxazol-3-yl)-, (S)-
이름 더 보기
CS-313SL 2511882-Oxazolidinone, 5-(methoxymethyl)-3-[6-(4,4,4-trifluorobutoxy)-1,2-benzisoxazol-3-yl]-, (5S)-(5S)-5-(methoxymethyl)-3-[6-(4,4,4-trifluorobutoxy)-1,2-benzoxazol-3-yl]-1,3-oxazolidin-2-one - [AC78030]
SQMNCLANJWZZOG-NSHDSACASA-Norb1699285SCHEMBL7377168DTXSID00430924BDBM50041003AKOS040749516PD117914HY-117502
물성
구조 계산 물성
- XLogP
- 3.3
- 극성 표면적
- 74 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 493
물리화학적 성질
- 끓는 점
- 444.8 · 444.8±45.0 °C(Predicted)
- 밀도
- 1.358 · 1.358±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- -1.1 · -1.10±0.30(Predicted)
화학 및 산업
공급사9 곳
AdooQ BioScience, LLC+1 (866) 930-6790 · [email protected]
Wuhan NCE Biomedical Co.,Ltd.4000-027-021 |24 +86-13986109188 | +86-15623472865 | +81-08033611988
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
斯派螺（武汉）药物研发有限公司[email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
Cckinase, Inc.+1 (732)236-3202 · [email protected]
Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
常州辰鸿生物科技有限公司+86-0519-85788828 +86-13775037613 · [email protected]
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…