CS-0914455
(S)-3-(4-(4-(piperidin-4-yl)butoxy)phenyl)-2-(N-(4-(piperidin-4-yl)butyl)butylsulfonamido)propanoic acid
Manufacturer: ChemScene
CAS Number: 2714335-86-9
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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
C₃₁H₅₃N₃O₅S
Molecular Weight
579.83
Synonyms
None
SMILES
[C@H](N(CCCCC1CCNCC1)S(CCCC)(=O)=O)(CC2=CC=C(OCCCCC3CCNCC3)C=C2)C(O)=O
Tpsa
107.97
Logp
4.8328
H Acceptors
6
H Donors
3
Rotatable Bonds
19
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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: C₃₁H₅₃N₃O₅S
Molecular Weight: 579.83
Synonyms: None
SMILES: [C@H](N(CCCCC1CCNCC1)S(CCCC)(=O)=O)(CC2=CC=C(OCCCCC3CCNCC3)C=C2)C(O)=O
Tpsa: 107.97
Logp: 4.8328
H Acceptors: 6
H Donors: 3
Rotatable Bonds: 19
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₅₃N₃O₅S
Molecular Weight:
579.83
Synonyms:
None
SMILES:
[C@H](N(CCCCC1CCNCC1)S(CCCC)(=O)=O)(CC2=CC=C(OCCCCC3CCNCC3)C=C2)C(O)=O
Tpsa:
107.97
Logp:
4.8328
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
19
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₇NO₅S
Molecular Weight: 287.33
Synonyms: None
SMILES: [C@@H](CC1=CC=C(O)C=C1)(NS(CCC)(=O)=O)C(O)=O
Tpsa: 103.7
Logp: 0.7173
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₇NO₅S
Molecular Weight:
287.33
Synonyms:
None
SMILES:
[C@@H](CC1=CC=C(O)C=C1)(NS(CCC)(=O)=O)C(O)=O
Tpsa:
103.7
Logp:
0.7173
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₄ClNO
Molecular Weight: 305.84
Synonyms: None
SMILES: [C@@H](OC1=C(C)C=CC=C1)(CCN(C)C)C2=CC=CC=C2.Cl
Tpsa: 12.47
Logp: 4.48862
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₄ClNO
Molecular Weight:
305.84
Synonyms:
None
SMILES:
[C@@H](OC1=C(C)C=CC=C1)(CCN(C)C)C2=CC=CC=C2.Cl
Tpsa:
12.47
Logp:
4.48862
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₀FNO
Molecular Weight: 273.35
Synonyms: None
SMILES: [C@@H](OC1=C(C)C(F)=CC=C1)(CCNC)C2=CC=CC=C2
Tpsa: 21.26
Logp: 3.86372
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₀FNO
Molecular Weight:
273.35
Synonyms:
None
SMILES:
[C@@H](OC1=C(C)C(F)=CC=C1)(CCNC)C2=CC=CC=C2
Tpsa:
21.26
Logp:
3.86372
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
6