1-[5-(2,3-dihydro-1,4-benzodioxin-2-yl)thieno[2,3-d]pyrimidin-4-yl]pyrrolidine

1-[5-(2,3-dihydro-1,4-benzodioxin-2-yl)thieno[2,3-d]pyrimidin-4-yl]pyrrolidine

Formula: C18H17N3O2S

SMILES: C1CCN(C1)C1=C2C(SC=C2C2COC3=C(O2)C=CC=C3)=NC=N1

IUPAC: 1-[5-(2,3-dihydro-1,4-benzodioxin-2-yl)thieno[2,3-d]pyrimidin-4-yl]pyrrolidine

InChI: InChI=1/C18H17N3O2S/c1-2-6-14-13(5-1)22-9-15(23-14)12-10-24-18-16(12)17(19-11-20-18)21-7-3-4-8-21/h1-2,5-6,10-11,15H,3-4,7-9H2

Composition: C (63.70%), H (5.05%), N (12.38%), O (9.43%), S (9.45%)

Molar Mass: 339.41

Atom Count: 41

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	339.104147973
Formal Charge	0
FSP3	0.33
Hetero Ring Count	4
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	NWVBMKUDSFGYDY-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	93.54
Topological Polar Surface Area	47.48
Polarizability	35.73
Ring Count	5
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H17N3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00