CS-1001236
7-(Aminocarbonyl)-5-[(2R)-2-[[2-[2-(2,2,2-trifluoroethoxy)phenoxy]ethyl]amino]propyl]-1H-indole-1-propanoic acid
Manufacturer: ChemScene
CAS Number: 1384966-05-5
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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
C₂₅H₂₈F₃N₃O₅
Molecular Weight
507.50
Synonyms
None
SMILES
C(CC(O)=O)N1C=2C(=CC(C[C@H](NCCOC3=C(OCC(F)(F)F)C=CC=C3)C)=CC2C(N)=O)C=C1
Tpsa
115.81
Logp
3.7556
H Acceptors
6
H Donors
3
Rotatable Bonds
13
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1384966-05-5 | KDM-3295 | 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: C₂₅H₂₈F₃N₃O₅
Molecular Weight: 507.50
Synonyms: None
SMILES: C(CC(O)=O)N1C=2C(=CC(C[C@H](NCCOC3=C(OCC(F)(F)F)C=CC=C3)C)=CC2C(N)=O)C=C1
Tpsa: 115.81
Logp: 3.7556
H Acceptors: 6
H Donors: 3
Rotatable Bonds: 13
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₂₈F₃N₃O₅
Molecular Weight:
507.50
Synonyms:
None
SMILES:
C(CC(O)=O)N1C=2C(=CC(C[C@H](NCCOC3=C(OCC(F)(F)F)C=CC=C3)C)=CC2C(N)=O)C=C1
Tpsa:
115.81
Logp:
3.7556
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
13
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₇NO₇
Molecular Weight: 299.28
Synonyms: None
SMILES: O=CC1=CC(OCCOC)=C(OCCOC)C=C1N(=O)=O
Tpsa: 97.13
Logp: 1.4577
H Acceptors: 7
H Donors: 0
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₇NO₇
Molecular Weight:
299.28
Synonyms:
None
SMILES:
O=CC1=CC(OCCOC)=C(OCCOC)C=C1N(=O)=O
Tpsa:
97.13
Logp:
1.4577
H Acceptors:
7
H Donors:
0
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₃H₅₅NO₁₅
Molecular Weight: 825.89
Synonyms: None
SMILES: O(C(=O)C1=CC=CC=C1)[C@H]2[C@]3([C@](C)(C(=O)[C@H](O)C=4C(C)(C)[C@@]2(O)C[C@H](OC([C@@H]([C@@H](NC(OC(C)(C)C)=O)C5=CC=CC=C5)O)=O)C4C)[C@@H](O)C[C@H](OC(C)=O)[C@]3(CO)O)[H]
Tpsa: 255.68
Logp: 2.214
H Acceptors: 15
H Donors: 7
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₃H₅₅NO₁₅
Molecular Weight:
825.89
Synonyms:
None
SMILES:
O(C(=O)C1=CC=CC=C1)[C@H]2[C@]3([C@](C)(C(=O)[C@H](O)C=4C(C)(C)[C@@]2(O)C[C@H](OC([C@@H]([C@@H](NC(OC(C)(C)C)=O)C5=CC=CC=C5)O)=O)C4C)[C@@H](O)C[C@H](OC(C)=O)[C@]3(CO)O)[H]
Tpsa:
255.68
Logp:
2.214
H Acceptors:
15
H Donors:
7
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₂₈N₆O₇S₃
Molecular Weight: 620.72
Synonyms: None
SMILES: C(OCOC(C(C)(C)C)=O)(=O)C=1N2[C@@]([C@H](NC(/C(=N\OC)/C3=CSC(N)=N3)=O)C2=O)(SCC1/C=C/C4=C(C)N=CS4)[H]
Tpsa: 175.4
Logp: 2.29812
H Acceptors: 14
H Donors: 2
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₂₈N₆O₇S₃
Molecular Weight:
620.72
Synonyms:
None
SMILES:
C(OCOC(C(C)(C)C)=O)(=O)C=1N2[C@@]([C@H](NC(/C(=N\OC)/C3=CSC(N)=N3)=O)C2=O)(SCC1/C=C/C4=C(C)N=CS4)[H]
Tpsa:
175.4
Logp:
2.29812
H Acceptors:
14
H Donors:
2
Rotatable Bonds:
9