Compound Summary
Compound Information
SB-705498
Compound Name: | SB-705498 |
Compound CID: | 9910486 |
Synonyms: | SB-705498 501951-42-4 SB705498 SB 705498 UNII-T74V9O0Y2W More... |
Iupac Name: | 1-(2-bromophenyl)-3-[(3R)-1-[5-(trifluoromethyl)pyridin-2-yl]pyrrolidin-3-yl]urea |
InChI: | InChI=1S/C17H16BrF3N4O/c18-13-3-1-2-4-14(13)24-16(26)23-12-7-8-25(10-12)15-6-5-11(9-22-15)17(19,20)21/h1-6,9,12H,7-8,10H2,(H2,23,24,26)/t12-/m1/s1 |
InChIKey: | JYILLRHXRVTRSH-GFCCVEGCSA-N |
Canonical Smiles: | C1CN(CC1NC(=O)NC2=CC=CC=C2Br)C3=NC=C(C=C3)C(F)(F)F |
Isomeric Smiles: | C1CN(C[C@@H]1NC(=O)NC2=CC=CC=C2Br)C3=NC=C(C=C3)C(F)(F)F |
Molecular Weight: | 429.2 |
Molecular Formula: | C17H16BrF3N4O |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
SB-705498
Molecular Weight: | 429.2 |
Molecular Formula: | C17H16BrF3N4O |
Hydrogen Bond Donor Count: | 2 |
Hydrogen Bond Acceptor Count: | 6 |
Rotatable Bond Count: | 3 |
Heavy Atom Count: | 26 |
Complexity: | 493 |
Synonyms
SB-705498
| SB-705498 | SB-705498 |
|---|---|
SB-705498 |
501951-42-4 |
SB705498 |
SB 705498 |
UNII-T74V9O0Y2W |
(R)-1-(2-bromophenyl)-3-(1-(5-(trifluoromethyl)pyridin-2-yl)pyrrolidin-3-yl)urea |
1-(2-bromophenyl)-3-(3R)-1-5-(trifluoromethyl)pyridin-2-ylpyrrolidin-3-ylurea |
T74V9O0Y2W |
N-(2-bromophenyl)-N-(3R)-1-5-(trifluoromethyl)-2-pyridinyl-3-pyrrolidinyl-urea |
cc-315 |
MLS006011113 |
CHEMBL207433 |
GTPL4311 |
SCHEMBL1350298 |
BMCL163287 Compound 15 |
BDBM20504 |
DTXSID20198236 |
HMS3884J16 |
BCP22698 |
EX-A4567 |
GSK705498 |
MFCD13152399 |
s2773 |
ZINC13985502 |
CCG-268991 |
CS-0757 |
DB11883 |
N-(2-Bromophenyl)-N-(3R)-1-5-(trifluoromethyl)-2-pyridinyl-3-pyrrolidinylurea |
NCGC00346690-01 |
AC-32677 |
AS-56093 |
HY-10633 |
SMR004702894 |
SW220117-1 |
Y0365 |
A871641 |
J-522879 |
Q27088737 |
N-(2-bromophenyl)-N-((R)-1-(5-trifluoromethyl-2-pyridyl)pyrrolidin-3-yl)urea" |
Urea, N-(2-bromophenyl)-N-((3R)-1-(5-(trifluoromethyl)-2-pyridinyl)-3- pyrrolidinyl)-" |
Experimental Data
SB-705498
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Brachionus manjavacas | 0.5 | umol/L | 0 | NS | 27484416 | Inactive | |||||||
| Brachionus manjavacas | 1 | umol/L | 0 | NS | 27484416 | Inactive |
Experimental Data Visualization
SB-705498
Statistics Data
SB-705498
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Brachionus manjavacas | 0 | 1 | 2 |
Statistics Data Visualization
SB-705498
