U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C40H57N5O2
Molecular Weight 639.9129
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TD-6301

SMILES

COC1=C(CN2CCC(CC2)N(CCCCCCCN3CC[C@H](C3)C(C(N)=O)(C4=CC=CC=C4)C5=CC=CC=C5)C(C)C)C=NC=C1

InChI

InChIKey=FJADIVYKWUDMEW-PSXMRANNSA-N
InChI=1S/C40H57N5O2/c1-32(2)45(37-21-27-44(28-22-37)30-33-29-42-23-19-38(33)47-3)25-14-6-4-5-13-24-43-26-20-36(31-43)40(39(41)46,34-15-9-7-10-16-34)35-17-11-8-12-18-35/h7-12,15-19,23,29,32,36-37H,4-6,13-14,20-22,24-28,30-31H2,1-3H3,(H2,41,46)/t36-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
TD6301
Preferred Name English
TD-6301
Code English
THRX-326151
Code English
2-((3S)-1-(7-(ISOPROPYL-(1-((4-METHOXY-3-PYRIDYL)METHYL)-4-PIPERIDYL)AMINO)HEPTYL)PYRROLIDIN-3-YL)-2,2-DIPHENYL-ACETAMIDE
Systematic Name English
(S)-4-(N-(7-(3-(CARBAMOYLDIPHENYLMETHYL)PYRROLIDIN-1-YL)HEPT-1-YL)-N-(ISOPROPYL)AMINO)-1-((4-METHOXYPYRIDIN-3-YL)METHYL)PIPERIDINE
Systematic Name English
3-PYRROLIDINEACETAMIDE, 1-(7-((1-((4-METHOXY-3-PYRIDINYL)METHYL)-4-PIPERIDINYL)(1-METHYLETHYL)AMINO)HEPTYL)-.ALPHA.,.ALPHA.-DIPHENYL-, (3S)-
Systematic Name English
Code System Code Type Description
FDA UNII
EPR5GNZ7KS
Created by admin on Tue Apr 01 16:31:34 GMT 2025 , Edited by admin on Tue Apr 01 16:31:34 GMT 2025
PRIMARY
CAS
690999-15-6
Created by admin on Tue Apr 01 16:31:34 GMT 2025 , Edited by admin on Tue Apr 01 16:31:34 GMT 2025
PRIMARY
PUBCHEM
10371936
Created by admin on Tue Apr 01 16:31:34 GMT 2025 , Edited by admin on Tue Apr 01 16:31:34 GMT 2025
PRIMARY