70454-37-4
7-(4-(6-CHLORONICOTINAMIDO)BUTYL)THEOPHYLLINE
Name
7-(4-(6-CHLORONICOTINAMIDO)BUTYL)THEOPHYLLINE
Formula
C17 H19 Cl N6 O3
MolWeight
390.829
1Identification
【Name】
7-(4-(6-CHLORONICOTINAMIDO)BUTYL)THEOPHYLLINE
【CAS】
【MDL】
MFCD01682316
【English Synonyms】
【Formula】
C17 H19 Cl N6 O3
【MolWeight】
390.829
【Inchi】
InChI=1S/C17H19ClN6O3/c1-22-14-13(16(26)23(2)17(22)27)24(10-21-14)8-4-3-7-19-15(25)11-5-6-12(18)20-9-11/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,19,25)
【InChIKey】
InChIKey=IFNZWKGWQUPUOR-UHFFFAOYSA-N
【SMILES】
Cn1c2c(c(=O)n(c1=O)C)n(cn2)CCCCNC(=O)c3ccc(nc3)Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:9
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
7-(4-(6-CHLORONICOTINAMIDO)BUTYL)THEOPHYLLINE.cml
Quick Release
TOP Suppliers
Youchemicals Limited
Catalog No:Y264210
Country/Region:China
Business Type:Trading Company
http://www.youchemicals.com
More 70454-37-4 Suppliers>>
Catalog No:Y264210
Country/Region:China
Business Type:Trading Company
http://www.youchemicals.com
More 70454-37-4 Suppliers>>