2-Methoxyethyl 6-(4-(acetyloxy)-3-ethoxyphenyl)-8-methyl-4-oxo-3,4-dihydro-2H,6H-pyrimido(2,1-B)(1,3)thiazine-7-carboxylate

https://huagongshe.com/de/chemical/3693396

Identifikatoren & physikalische Daten

CAS No.	609794-74-3
Summenformel	C22H26N2O7S
Durchschnittliche Molmasse	462,5 g/mol
Monoisotopische Masse	462,14607235 g/mol
SMILES	CCOc1cc(C2C(C(=O)OCCOC)=C(C)N=C3SCCC(=O)N32)ccc1OC(C)=O
InChIKey	BFKIFIZWGVJEAP-UHFFFAOYSA-N
PubChem CID	3693396
EC No.	647-051-0

Chemische & physikalische Eigenschaften

XLogP	1,8
Polarare Oberfläche (TPSA)	129
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	9
Frei drehbare Bindungen	10
Schwere Atome	32
Formalladung	0
Komplexität	797

Sicherheit & Vorschriften

GHS-Einstufung	WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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	Acute Tox. 4 (100%)

GHS-Einstufung

WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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

Acute Tox. 4 (100%)