Text Search
Structure Search

(3S)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-4-(3-methylphenyl)butanoic acid

(3S)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-4-(3-methylphenyl)butanoic acid

CAS: 270062-94-7

Formula: C26H25NO4

SMILES: CC1=CC(C[C@@H](CC(O)=O)NC(=O)OCC2C3=CC=CC=C3C3=CC=CC=C23)=CC=C1

IUPAC: (3S)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-(3-methylphenyl)butanoic acid

InChI: InChI=1S/C26H25NO4/c1-17-7-6-8-18(13-17)14-19(15-25(28)29)27-26(30)31-16-24-22-11-4-2-9-20(22)21-10-3-5-12-23(21)24/h2-13,19,24H,14-16H2,1H3,(H,27,30)(H,28,29)/t19-/m0/s1

Composition: C (75.16%), H (6.07%), N (3.37%), O (15.40%)

Molar Mass: 415.489

Atom Count: 56

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 415.178358289
Formal Charge 0
FSP3 0.23
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey UKIDBCGNTDOQRO-IBGZPJMESA-N
Lipinski's Rule of Five
Molar Refractivity 118.86
Topological Polar Surface Area 75.63
Polarizability 47.21
Ring Count 4
Rotatable Bond Count 8

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
AA BLOCKS INC
Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 270062-94-7 $95.45-$281.75$95.45$163.30$281.75
Request Quote
LabNetwork INC
Purity LeadTime CAS PacketSize UnitPrice
95% 1 Day 270062-94-7 $321.30$321.30
Request Quote