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3-{2-[(triphenylmethyl)amino]ethyl}-1H-indol-5-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate

3-{2-[(triphenylmethyl)amino]ethyl}-1H-indol-5-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate

Formula: C43H43N3O4

SMILES: O=C(CCCCCNC(=O)OCC1=CC=CC=C1)OC1=CC=C2NC=C(CCNC(C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)C2=C1

IUPAC: 3-{2-[(triphenylmethyl)amino]ethyl}-1H-indol-5-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate

InChI: InChI=1S/C43H43N3O4/c47-41(24-14-5-15-28-44-42(48)49-32-33-16-6-1-7-17-33)50-38-25-26-40-39(30-38)34(31-45-40)27-29-46-43(35-18-8-2-9-19-35,36-20-10-3-11-21-36)37-22-12-4-13-23-37/h1-4,6-13,16-23,25-26,30-31,45-46H,5,14-15,24,27-29,32H2,(H,44,48)

Composition: C (77.57%), H (6.51%), N (6.31%), O (9.61%)

Molar Mass: 665.834

Atom Count: 93

Heavy Atom Count: 50

Properties
Properties
Common Names N/A
Aromatic Ring Count 6
Asymmetric Atom Count 0
Exact Mass 665.325356877
Formal Charge 0
FSP3 0.21
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey ODUMKZCGLZKICP-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 199.03
Topological Polar Surface Area 92.45
Polarizability 78.33
Ring Count 6
Rotatable Bond Count 18

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C43H43N3O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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