3-(cyclopropylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-propylurea

3-(cyclopropylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-propylurea

CAS: 865659-88-7

Formula: C16H22N2O3

SMILES: CCCN(CC1CC1)C(=O)NC1=CC2=C(OCCO2)C=C1

IUPAC: 3-(cyclopropylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-propylurea

InChI: InChI=1S/C16H22N2O3/c1-2-7-18(11-12-3-4-12)16(19)17-13-5-6-14-15(10-13)21-9-8-20-14/h5-6,10,12H,2-4,7-9,11H2,1H3,(H,17,19)

Composition: C (66.18%), H (7.64%), N (9.65%), O (16.53%)

Molar Mass: 290.363

Atom Count: 43

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	290.163042576
Formal Charge	0
FSP3	0.56
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	BRHSIPGNZOVYBV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	81.56
Topological Polar Surface Area	50.8
Polarizability	30.98
Ring Count	3
Rotatable Bond Count	5

Suppliers

Key Organics Ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	865659-88-7		$51.35-$524.40$51.35$63.37$86.31$524.40