benzyl 3-carbamothioylpiperidine-1-carboxylate

benzyl 3-carbamothioylpiperidine-1-carboxylate

CAS: 569348-15-8

Formula: C14H18N2O2S

SMILES: NC(=S)C1CCCN(C1)C(=O)OCC1=CC=CC=C1

IUPAC: benzyl 3-carbamothioylpiperidine-1-carboxylate

InChI: InChI=1/C14H18N2O2S/c15-13(19)12-7-4-8-16(9-12)14(17)18-10-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H2,15,19)

Composition: C (60.41%), H (6.52%), N (10.06%), O (11.49%), S (11.52%)

Molar Mass: 278.37

Atom Count: 37

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	278.108899002
Formal Charge	0
FSP3	0.43
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	AOYXSKQMDOWLIA-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	78.54
Topological Polar Surface Area	55.56
Polarizability	30.81
Ring Count	2
Rotatable Bond Count	4

Suppliers

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<6 Days	569348-15-8		$395.60-$1,984.90$395.60$790.05$1,984.90

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	569348-15-8		$1,540.00-$2,420.00$1,540.00$2,420.00