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4-[(4-butanamidophenyl)carbamoyl]butanoic acid

4-[(4-butanamidophenyl)carbamoyl]butanoic acid

CAS: 940477-91-8

Formula: C15H20N2O4

SMILES: CCCC(=O)NC1=CC=C(NC(=O)CCCC(O)=O)C=C1

IUPAC: 4-[(4-butanamidophenyl)carbamoyl]butanoic acid

InChI: InChI=1S/C15H20N2O4/c1-2-4-13(18)16-11-7-9-12(10-8-11)17-14(19)5-3-6-15(20)21/h7-10H,2-6H2,1H3,(H,16,18)(H,17,19)(H,20,21)

Composition: C (61.63%), H (6.90%), N (9.58%), O (21.89%)

Molar Mass: 292.335

Atom Count: 41

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 292.142307132
Formal Charge 0
FSP3 0.4
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey NQYALWFVXWRKMW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 80.51
Topological Polar Surface Area 95.5
Polarizability 29.85
Ring Count 1
Rotatable Bond Count 8

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95% <2 Days 940477-91-8 $212.83-$328.34$212.83$328.34
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