6-tert-butyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-amine

6-tert-butyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-amine

CAS: 590351-08-9

Formula: C17H26N2O2S

SMILES: CC(C)(C)C1CCC2=C(C1)SC(N)=C2C(=O)N1CCOCC1

IUPAC: 6-tert-butyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-amine

InChI: InChI=1/C17H26N2O2S/c1-17(2,3)11-4-5-12-13(10-11)22-15(18)14(12)16(20)19-6-8-21-9-7-19/h11H,4-10,18H2,1-3H3

Composition: C (63.32%), H (8.13%), N (8.69%), O (9.92%), S (9.94%)

Molar Mass: 322.47

Atom Count: 48

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	322.171499259
Formal Charge	0
FSP3	0.71
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	JQLDWDHDHOKDNH-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	90.56
Topological Polar Surface Area	55.56
Polarizability	34.15
Ring Count	3
Rotatable Bond Count	2

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