81735-48-0
1-((4,4-DIMETHYL-4H-1,3-BENZOTHIAZIN-2-YL)METHYL)-3-PHENYL-2-PIPERAZIN ONE OXALATE
Name
1-((4,4-DIMETHYL-4H-1,3-BENZOTHIAZIN-2-YL)METHYL)-3-PHENYL-2-PIPERAZIN ONE OXALATE
Formula
C21 H23 N3 O S . C2 H2 O4
MolWeight
455.533
1Identification
【Name】
1-((4,4-DIMETHYL-4H-1,3-BENZOTHIAZIN-2-YL)METHYL)-3-PHENYL-2-PIPERAZIN ONE OXALATE
【CAS】
【MDL】
MFCD01701784
【English Synonyms】
【Formula】
C21 H23 N3 O S . C2 H2 O4
【MolWeight】
455.533
【Inchi】
InChI=1S/C21H23N3OS.C2H2O4/c1-21(2)16-10-6-7-11-17(16)26-18(23-21)14-24-13-12-22-19(20(24)25)15-8-4-3-5-9-15;3-1(4)2(5)6/h3-11,19,22H,12-14H2,1-2H3;(H,3,4)(H,5,6)
【InChIKey】
InChIKey=NHNZEOPXABIHKI-UHFFFAOYSA-N
【SMILES】
CC1(c2ccccc2SC(=N1)CN3CCNC(C3=O)c4ccccc4)C.C(=O)(C(=O)O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-((4,4-DIMETHYL-4H-1,3-BENZOTHIAZIN-2-YL)METHYL)-3-PHENYL-2-PIPERAZIN ONE OXALATE.cml
Quick Release
TOP Suppliers
Youchemicals Limited
Catalog No:Y301198
Country/Region:China
Business Type:Trading Company
http://www.youchemicals.com
More 81735-48-0 Suppliers>>
Catalog No:Y301198
Country/Region:China
Business Type:Trading Company
http://www.youchemicals.com
More 81735-48-0 Suppliers>>