methyl 5-({[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl}amino)-2-(morpholin-4-yl)benzoate

methyl 5-({[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl}amino)-2-(morpholin-4-yl)benzoate

Formula: C25H28N2O5S

SMILES: COC(=O)C1=CC(NCC2=CC=C(OCC3=CC=CS3)C(OC)=C2)=CC=C1N1CCOCC1

IUPAC: methyl 5-[({3-methoxy-4-[(thiophen-2-yl)methoxy]phenyl}methyl)amino]-2-(morpholin-4-yl)benzoate

InChI: InChI=1S/C25H28N2O5S/c1-29-24-14-18(5-8-23(24)32-17-20-4-3-13-33-20)16-26-19-6-7-22(21(15-19)25(28)30-2)27-9-11-31-12-10-27/h3-8,13-15,26H,9-12,16-17H2,1-2H3

Composition: C (64.08%), H (6.02%), N (5.98%), O (17.07%), S (6.84%)

Molar Mass: 468.57

Atom Count: 61

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	468.171893184
Formal Charge	0
FSP3	0.32
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	NRMDNFKDEPVYNE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	130.82
Topological Polar Surface Area	69.26
Polarizability	49.09
Ring Count	4
Rotatable Bond Count	10

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H28N2O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00