N-[3-(thiophen-2-ylformamido)propyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

N-[3-(thiophen-2-ylformamido)propyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Formula: C17H18N2O4S

SMILES: O=C(NCCCNC(=O)C1=CC=C2OCCOC2=C1)C1=CC=CS1

IUPAC: N-{3-[(thiophen-2-yl)formamido]propyl}-2,3-dihydro-1,4-benzodioxine-6-carboxamide

InChI: InChI=1S/C17H18N2O4S/c20-16(12-4-5-13-14(11-12)23-9-8-22-13)18-6-2-7-19-17(21)15-3-1-10-24-15/h1,3-5,10-11H,2,6-9H2,(H,18,20)(H,19,21)

Composition: C (58.95%), H (5.24%), N (8.09%), O (18.47%), S (9.26%)

Molar Mass: 346.4

Atom Count: 42

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	346.098728242
Formal Charge	0
FSP3	0.29
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	RMHGJQNGURFKKU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	90.81
Topological Polar Surface Area	76.66
Polarizability	34.17
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H18N2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00