(3R)-3-carbamoyl-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid

(3R)-3-carbamoyl-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid

CAS: 200335-41-7

Formula: C19H18N2O5

SMILES: NC(=O)[C@@H](CC(O)=O)NC(=O)OCC1C2=CC=CC=C2C2=C1C=CC=C2

IUPAC: (3R)-3-carbamoyl-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid

InChI: InChI=1S/C19H18N2O5/c20-18(24)16(9-17(22)23)21-19(25)26-10-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,15-16H,9-10H2,(H2,20,24)(H,21,25)(H,22,23)/t16-/m1/s1

Composition: C (64.40%), H (5.12%), N (7.91%), O (22.57%)

Molar Mass: 354.362

Atom Count: 44

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	354.121571688
Formal Charge	0
FSP3	0.21
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	VHRMWRHTRSQVJJ-MRXNPFEDSA-N
Lipinski's Rule of Five	1
Molar Refractivity	92.43
Topological Polar Surface Area	118.72
Polarizability	37.06
Ring Count	3
Rotatable Bond Count	7

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