76360-85-5
ETHYL 5-HYDROXY-2-(METHYLTHIO)-7-OXO-8-PROPYL-7,8-DIHYDROPYRIDO[2,3-D]PYRIMIDINE-6-CARBOXYLATE
NameETHYL 5-HYDROXY-2-(METHYLTHIO)-7-OXO-8-PROPYL-7,8-DIHYDROPYRIDO[2,3-D]PYRIMIDINE-6-CARBOXYLATE
1Identification
【Name】
ETHYL 5-HYDROXY-2-(METHYLTHIO)-7-OXO-8-PROPYL-7,8-DIHYDROPYRIDO[2,3-D]PYRIMIDINE-6-CARBOXYLATE
【CAS】
【MDL】
MFCD17011942
【English Synonyms】
【Formula】
C14 H17 N3 O4 S
【MolWeight】
323.371
【Inchi】
InChI=1S/C14H17N3O4S/c1-4-6-17-11-8(7-15-14(16-11)22-3)10(18)9(12(17)19)13(20)21-5-2/h7,18H,4-6H2,1-3H3
【InChIKey】
InChIKey=RKBWKNDYYVDLAD-UHFFFAOYSA-N
【SMILES】
CCCn1c2c(cnc(n2)SC)c(c(c1=O)C(=O)OCC)O
【MOL File】
ETHYL 5-HYDROXY-2-(M….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 5-HYDROXY-2-(METHYLTHIO)-7-OXO-8-PROPYL-7,8-DIHYDROPYRIDO[2,3-D]PYRIMIDINE-6-CARBOXYLATE.cml