CS-1001912
2,6-Heptadienoic acid, 7-[4-(4-fluorophenyl)-6-(1-methylethyl)-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl]-5-hydroxy-, sodium salt (1:1), (2Z,5R,6E)-
Manufacturer: ChemScene
CAS Number: 1659301-59-3
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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
C₂₂H₂₆FN₃NaO₅S
Molecular Weight
486.51
Synonyms
None
SMILES
C(=C/[C@@H](C/C=C\C(O)=O)O)\C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2.[Na]
Tpsa
120.69
Logp
2.8261
H Acceptors
6
H Donors
2
Rotatable Bonds
9
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1659301-59-3 | | 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: C₂₂H₂₆FN₃NaO₅S
Molecular Weight: 486.51
Synonyms: None
SMILES: C(=C/[C@@H](C/C=C\C(O)=O)O)\C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2.[Na]
Tpsa: 120.69
Logp: 2.8261
H Acceptors: 6
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:
C₂₂H₂₆FN₃NaO₅S
Molecular Weight:
486.51
Synonyms:
None
SMILES:
C(=C/[C@@H](C/C=C\C(O)=O)O)\C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2.[Na]
Tpsa:
120.69
Logp:
2.8261
H Acceptors:
6
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: C₂₂H₂₆FN₃O₅S
Molecular Weight: 463.52
Synonyms: None
SMILES: C(=C/[C@@H](C/C=C\C(O)=O)O)\C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2
Tpsa: 120.69
Logp: 3.2069
H Acceptors: 6
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:
C₂₂H₂₆FN₃O₅S
Molecular Weight:
463.52
Synonyms:
None
SMILES:
C(=C/[C@@H](C/C=C\C(O)=O)O)\C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2
Tpsa:
120.69
Logp:
3.2069
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
9
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₃₁NO₇
Molecular Weight: 445.51
Synonyms: None
SMILES: O=C(O)CCC(=O)OC(COC=1C=CC=CC1C(O)CC=2C=CC=C(OC)C2)CN(C)C
Tpsa: 105.53
Logp: 2.6883
H Acceptors: 7
H Donors: 2
Rotatable Bonds: 13
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₃₁NO₇
Molecular Weight:
445.51
Synonyms:
None
SMILES:
O=C(O)CCC(=O)OC(COC=1C=CC=CC1C(O)CC=2C=CC=C(OC)C2)CN(C)C
Tpsa:
105.53
Logp:
2.6883
H Acceptors:
7
H Donors:
2
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: C₂₃H₂₉NO₆
Molecular Weight: 415.48
Synonyms: None
SMILES: O=C(O)CCC(=O)OC(COC=1C=CC=CC1CCC=2C=CC=C(OC)C2)CNC
Tpsa: 94.09
Logp: 2.8552
H Acceptors: 6
H Donors: 2
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:
C₂₃H₂₉NO₆
Molecular Weight:
415.48
Synonyms:
None
SMILES:
O=C(O)CCC(=O)OC(COC=1C=CC=CC1CCC=2C=CC=C(OC)C2)CNC
Tpsa:
94.09
Logp:
2.8552
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
13