Ethyl ({[(3-ethyl-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-D]pyrimidin-2-YL)sulfanyl]acetyl}amino)acetate

SALOR-INT L412600-1EA · ethyl 2-(2-((3-ethyl-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)thio)acetamido)acetate · ETHYL (([(3-ETHYL-5,6-DIMETHYL-4-OXO-3,4-DIHYDROTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETYL)AMINO)ACETATE · Glycine, N-[[(3-ethyl-3,4-dihydro-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)thio]acetyl]-, ethyl ester (9CI)

https://huagongshe.com/ko/chemical/3693393

Ethyl ({[(3-ethyl-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-D]pyrimidin-2-YL)sulfanyl]acetyl}amino)acetate 분자 구조식

식별자 및 물리적 특성

CAS No.	618427-72-8
분자식	C16H21N3O4S2
평균 분자량	383.5 g/mol
단동위원소 질량	383.09734851 g/mol
SMILES	CCOC(=O)CNC(=O)CSc1nc2sc(C)c(C)c2c(=O)n1CC
InChIKey	NRDASRJESYTZPU-UHFFFAOYSA-N
PubChem CID	3693393
EC No.	638-134-2

화학 및 물리적 성질

XLogP	2.6
극성 표면적	142
수소 결합 공여자 수	1
수소 결합 수용자 수	7
회전 가능 결합 수	8
무거운 원자 수	25
형식 전하	0
복잡도	570
밀도	1.38±0.1 g/cm3(Predicted)
pKa(산도 계수)	12.80±0.46(Predicted)

안전 및 규제

GHS 분류	WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Skin Irrit. 2 (100%)
신호 어	Warning
유해·위험 문구	암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H315