Ethyl 5-hydroxy-2-(methylthio)-7-oxo-8-propyl-7,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylate

HCID 54729612

기본 정보

CAS
76360-85-5
표준 SMILES
CCCn1c(=O)c(C(=O)OCC)c(O)c2cnc(SC)nc21
InChIKey
RKBWKNDYYVDLAD-UHFFFAOYSA-N
분자식
C14H17N3O4S
평균 분자량
323.37 g/mol
단동위원소 질량
323.09397702

이름 및 식별자

우선 이름
Ethyl 5-hydroxy-2-(methylthio)-7-oxo-8-propyl-7,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylate
IUPAC
ethyl 5-hydroxy-2-methylsulfanyl-7-oxo-8-propylpyrido[2,3-d]pyrimidine-6-carboxylate
영어명
ethyl 5-hydroxy-2-(methylthio)-7-oxo-8-propyl-7,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylate
분자식
C14H17N3O4S
분자량
323.37

이름 및 동의어

76360-85-5Ethyl 5-hydroxy-2-(methylthio)-7-oxo-8-propyl-7,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylateethyl 5-hydroxy-2-methylsulfanyl-7-oxo-8-propylpyrido[2,3-d]pyrimidine-6-carboxylateSCHEMBL11155647DTXSID20716353RKBWKNDYYVDLAD-UHFFFAOYSA-NAKOS015856206ethyl5-hydroxy-2-(methylthio)-7-oxo-8-propyl-7,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylateDB-0751157,8-dihydro-5-hydroxy-2-(methylthio)-7-oxo-8-propylpyrido[2,3-d]-pyrimidine-6-carboxylic acid ethyl ester7,8-dihydro-5-hydroxy-2-(methylthio)-7-oxo-8-propylpyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl esterEthyl 5-hydroxy-2-(methylsulfanyl)-7-oxo-8-propyl-7,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylate
이름 더 보기
ethyl 5-hydroxy-2-(Methylthio)-7-oxo-8-propyl-7,8-dihydropyrido[Pyrido[2,3-d]pyrimidine-6-carboxylic acid, 7,8-dihydro-5-hydroxy-2-(methylthio)-7-oxo-8-propyl-, ethyl ester

데이터베이스 식별자

CAS
76360-85-5
PubChem CID
54729612
DTXSID
DTXSID20716353

물성

구조 계산 물성

XLogP
2.2
극성 표면적
118 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
7
회전 가능 결합 수
6
무거운 원자 수
22

안전 및 규제

안전 데이터

위험 등급
IRRITANT

화학 및 산업

공급사1 곳

上海相辉医药科技有限公司[email protected]

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