CS-0914116
(R)-4-((2-(5-(2-fluoro-3-hydroxyphenyl)-3-(2-fluoro-6-(trifluoromethyl)benzyl)-4-methyl-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl)-1-phenylethyl)amino)butanoic acid hydrochloride
Manufacturer: ChemScene
CAS Number: 832720-51-1
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₃₁H₂₈F₅N₃O₅
Molecular Weight
617.56
Synonyms
None
SMILES
CC1=C(C(=O)N(C[C@H](NCCCC(O)=O)C2=CC=CC=C2)C(=O)N1CC3=C(C(F)(F)F)C=CC=C3F)C4=C(F)C(O)=CC=C4
Tpsa
113.56
Logp
5.23202
H Acceptors
7
H Donors
3
Rotatable Bonds
11
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 832720-51-1 | O-DEMETHYL ELAGOLIX | A2B Chem | -- |
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₁H₂₈F₅N₃O₅
Molecular Weight: 617.56
Synonyms: None
SMILES: CC1=C(C(=O)N(C[C@H](NCCCC(O)=O)C2=CC=CC=C2)C(=O)N1CC3=C(C(F)(F)F)C=CC=C3F)C4=C(F)C(O)=CC=C4
Tpsa: 113.56
Logp: 5.23202
H Acceptors: 7
H Donors: 3
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₂₈F₅N₃O₅
Molecular Weight:
617.56
Synonyms:
None
SMILES:
CC1=C(C(=O)N(C[C@H](NCCCC(O)=O)C2=CC=CC=C2)C(=O)N1CC3=C(C(F)(F)F)C=CC=C3F)C4=C(F)C(O)=CC=C4
Tpsa:
113.56
Logp:
5.23202
H Acceptors:
7
H Donors:
3
Rotatable Bonds:
11
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₆H₃₆F₅N₃O₇
Molecular Weight: 717.68
Synonyms: None
SMILES: O=C1C(=C(C)N(CC2=C(C(F)(F)F)C=CC=C2F)C(=O)N1C[C@H](N(CCCC(O)=O)CCCC(O)=O)C3=CC=CC=C3)C4=C(F)C(OC)=CC=C4
Tpsa: 131.07
Logp: 6.11222
H Acceptors: 8
H Donors: 2
Rotatable Bonds: 16
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₆H₃₆F₅N₃O₇
Molecular Weight:
717.68
Synonyms:
None
SMILES:
O=C1C(=C(C)N(CC2=C(C(F)(F)F)C=CC=C2F)C(=O)N1C[C@H](N(CCCC(O)=O)CCCC(O)=O)C3=CC=CC=C3)C4=C(F)C(OC)=CC=C4
Tpsa:
131.07
Logp:
6.11222
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
16
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₀H₄₄F₅N₃O₇
Molecular Weight: 773.79
Synonyms: None
SMILES: O=C1C(=C(C)N(CC2=C(C(F)(F)F)C=CC=C2F)C(=O)N1C[C@H](N(CCCC(OCC)=O)CCCC(OCC)=O)C3=CC=CC=C3)C4=C(F)C(OC)=CC=C4
Tpsa: 109.07
Logp: 7.06922
H Acceptors: 10
H Donors: 0
Rotatable Bonds: 18
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₀H₄₄F₅N₃O₇
Molecular Weight:
773.79
Synonyms:
None
SMILES:
O=C1C(=C(C)N(CC2=C(C(F)(F)F)C=CC=C2F)C(=O)N1C[C@H](N(CCCC(OCC)=O)CCCC(OCC)=O)C3=CC=CC=C3)C4=C(F)C(OC)=CC=C4
Tpsa:
109.07
Logp:
7.06922
H Acceptors:
10
H Donors:
0
Rotatable Bonds:
18
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₂H₂₈F₅N₃O₄
Molecular Weight: 613.57
Synonyms: None
SMILES: O=C1C(=C(C)N(CC2=C(C(F)(F)F)C=CC=C2F)C(=O)N1C[C@H](N3C(=O)CCC3)C4=CC=CC=C4)C5=C(F)C(OC)=CC=C5
Tpsa: 73.54
Logp: 5.70302
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₂H₂₈F₅N₃O₄
Molecular Weight:
613.57
Synonyms:
None
SMILES:
O=C1C(=C(C)N(CC2=C(C(F)(F)F)C=CC=C2F)C(=O)N1C[C@H](N3C(=O)CCC3)C4=CC=CC=C4)C5=C(F)C(OC)=CC=C5
Tpsa:
73.54
Logp:
5.70302
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
8