Text Search
Structure Search

2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-[5-(naphthalen-1-ylmethyl)-1,3-thiazol-2-yl]acetamide

2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-[5-(naphthalen-1-ylmethyl)-1,3-thiazol-2-yl]acetamide

CAS: 709002-46-0

Formula: C22H20N4OS2

SMILES: CC1=CC(C)=NC(SCC(=O)NC2=NC=C(CC3=CC=CC4=CC=CC=C34)S2)=N1

IUPAC: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-{5-[(naphthalen-1-yl)methyl]-1,3-thiazol-2-yl}acetamide

InChI: InChI=1S/C22H20N4OS2/c1-14-10-15(2)25-22(24-14)28-13-20(27)26-21-23-12-18(29-21)11-17-8-5-7-16-6-3-4-9-19(16)17/h3-10,12H,11,13H2,1-2H3,(H,23,26,27)

Composition: C (62.83%), H (4.79%), N (13.32%), O (3.80%), S (15.25%)

Molar Mass: 420.55

Atom Count: 49

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 420.107853628
Formal Charge 0
FSP3 0.18
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey MENNDDDTIIZDDN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 119.93
Topological Polar Surface Area 67.77
Polarizability 46.26
Ring Count 4
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Selleck Chemicals
Purity LeadTime CAS UnitPrice
98% <10 Days 709002-46-0 Quote Only
Molnova Chemicals
Purity LeadTime CAS PacketSize UnitPrice
98% <4 Days 709002-46-0 $38.22-$405.90$38.22$55.04$83.32$158.23$250.72$405.90
Request Quote