N-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}-3-methylbutanamide

N-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}-3-methylbutanamide

Formula: C14H21N3O3S

SMILES: COC1=CC=C(NC(=S)NNC(=O)CC(C)C)C(OC)=C1

IUPAC: N-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}-3-methylbutanamide

InChI: InChI=1S/C14H21N3O3S/c1-9(2)7-13(18)16-17-14(21)15-11-6-5-10(19-3)8-12(11)20-4/h5-6,8-9H,7H2,1-4H3,(H,16,18)(H2,15,17,21)

Composition: C (54.00%), H (6.80%), N (13.49%), O (15.41%), S (10.30%)

Molar Mass: 311.4

Atom Count: 42

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	311.130362722
Formal Charge	0
FSP3	0.43
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
InChIKey	DHNNOORKORKJKH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	87.16
Topological Polar Surface Area	71.62
Polarizability	33.33
Ring Count	1
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H21N3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00