2-{[4-(morpholin-4-yl)-6-(phenylamino)-1,3,5-triazin-2-yl]sulfanyl}-N-(1,3-thiazol-2-yl)propanamide

2-{[4-(morpholin-4-yl)-6-(phenylamino)-1,3,5-triazin-2-yl]sulfanyl}-N-(1,3-thiazol-2-yl)propanamide

Formula: C19H21N7O2S2

SMILES: CC(SC1=NC(NC2=CC=CC=C2)=NC(=N1)N1CCOCC1)C(=O)NC1=NC=CS1

IUPAC: 2-{[4-(morpholin-4-yl)-6-(phenylamino)-1,3,5-triazin-2-yl]sulfanyl}-N-(1,3-thiazol-2-yl)propanamide

InChI: InChI=1/C19H21N7O2S2/c1-13(15(27)22-18-20-7-12-29-18)30-19-24-16(21-14-5-3-2-4-6-14)23-17(25-19)26-8-10-28-11-9-26/h2-7,12-13H,8-11H2,1H3,(H,20,22,27)(H,21,23,24,25)

Composition: C (51.45%), H (4.77%), N (22.11%), O (7.21%), S (14.46%)

Molar Mass: 443.54

Atom Count: 51

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	443.119815292
Formal Charge	0
FSP3	0.32
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	2
InChIKey	UZUXAPBTNRJWNX-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	120.79
Topological Polar Surface Area	105.16
Polarizability	44.11
Ring Count	4
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H21N7O2S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00