기본 정보
- CAS
403848-01-1- 표준 SMILES
CCN[C@H]1C[C@H](C)S(=O)(=O)c2sccc21- InChIKey
CSXRPEGBUGCAHV-CBAPKCEASA-N- 분자식
- C10H15NO2S2
- 평균 분자량
- 245.4 g/mol
- 단동위원소 질량
- 245.05442107
이름 및 식별자
- 우선 이름
- (4S,6S)-N-ethyl-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-amine
- IUPAC
- (4S,6S)-N-ethyl-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-amine
- 영어명
- 4H-Thieno[2,3-b]thiopyran-4-amine,N-ethyl-5,6-dihydro-6-methyl-, 7,7-dioxide, (4S,6S)
- 분자식
- C10H15NO2S2
- 분자량
- 245.36
이름 및 동의어
403848-01-1(4S,6S)-N-ethyl-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-amineDorzolamide Impurity 44SCHEMBL4196353DTXSID20431079(4S,6S)-4-(Ethylamino)-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran 7,7-dioxide4H-Thieno[2,3-b]thiopyran-4-amine,N-ethyl-5,6-dihydro-6-methyl-, 7,7-dioxide, (4S,6S)(4S,6S)-4-(Ethylamino)-6-methyl-5,6-dihydro-7lambda~6~-thieno[2,3-b]thiopyran-7,7(4H)-dioneDorzolamide Impurity 31Desaminosulfonyl DorzolamideDorzolamide Desaminosulfonyl4H-THIENO[2,3-B]THIOPYRAN-4-AMINE
이름 더 보기
Dorzolamide Desaminosulfonyl HClQ: What is Dorzolamide Desaminosulfonyl HCl Q: What is the CAS Number of Dorzolamide Desaminosulfonyl HCl Q: What are the applications of Dorzolamide Desaminosulfonyl HCl
데이터베이스 식별자
- CAS
403848-01-1
물성
구조 계산 물성
- XLogP
- 1.5
- 극성 표면적
- 82.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 15
- 형식 전하
- 0
- 복잡도
- 323
물리화학적 성질
- 끓는 점
- 406.6 · 406.6±45.0 °C(Predicted)
- 밀도
- 1.3 · 1.30±0.1 g/cm3(Predicted)
- 용해도
- 에 용해됨메탄올; 에틸아세테이트; DCM;
- 산도 계수 (pKa)
- 7.62 · 7.62±0.40(Predicted)
화학 및 산업
응용 분야
용도Desaminosulfonyl Dorzolamide is an intermediate used in the synthesis of 2-Desaminosulfonyl 3-Aminosulfonyl Dorzolamide (D288235), which is a useful synthetic compound. Also, it is derived from (4R,6S)-5,6-Dihydro-6-methyl-4H-thieno[2,3-b]thiopyran-4-ol 7,7-Dioxide (T344510), which is an analog of topically-active carbonic anhydrase inhibitor MK-507, commonly known Dorzolamide (D535100).
공급사9 곳
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