methyl 4-(4-tert-butylphenyl)-6-(2-methoxy-2-oxoethylidene)-2-oxo-1,3-diazinane-5-carboxylate

methyl 4-(4-tert-butylphenyl)-6-(2-methoxy-2-oxoethylidene)-2-oxo-1,3-diazinane-5-carboxylate

CAS: 952183-65-2

Formula: C19H24N2O5

SMILES: COC(=O)C=C1NC(=O)NC(C1C(=O)OC)C1=CC=C(C=C1)C(C)(C)C

IUPAC: methyl 4-(4-tert-butylphenyl)-6-(2-methoxy-2-oxoethylidene)-2-oxo-1,3-diazinane-5-carboxylate

InChI: InChI=1/C19H24N2O5/c1-19(2,3)12-8-6-11(7-9-12)16-15(17(23)26-5)13(10-14(22)25-4)20-18(24)21-16/h6-10,15-16H,1-5H3,(H2,20,21,24)

Composition: C (63.32%), H (6.71%), N (7.77%), O (22.20%)

Molar Mass: 360.41

Atom Count: 50

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	360.168521881
Formal Charge	0
FSP3	0.42
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	CKDDCCVTOWVLMK-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	96.37
Topological Polar Surface Area	93.73
Polarizability	37.13
Ring Count	2
Rotatable Bond Count	6

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	952183-65-2		$51.35-$359.43$51.35$63.37$75.38$86.31$120.18$359.43