CS-0532970
7,7'-((3-Chloro-6-methyl-5,5-dioxido-6,11-dihydrodibenzo[c,f][1,2]thiazepin-11-yl)azanediyl)diheptanoic acid Tianeptine Impurity
Manufacturer: ChemScene
CAS Number: 768351-55-9
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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
C₂₈H₃₇ClN₂O₆S
Molecular Weight
565.12
Synonyms
Tianeptine sodium impurity E [EP]
SMILES
O=C(CCCCCCN(C1C2=C(N(S(=O)(C3=CC(Cl)=CC=C31)=O)C)C=CC=C2)CCCCCCC(O)=O)O
Tpsa
115.22
Logp
5.9401
H Acceptors
5
H Donors
2
Rotatable Bonds
15
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 768351-55-9 | Tianeptine Impurity E | A2B Chem | -- |
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: C₂₈H₃₇ClN₂O₆S
Molecular Weight: 565.12
Synonyms: Tianeptine sodium impurity E [EP]
SMILES: O=C(CCCCCCN(C1C2=C(N(S(=O)(C3=CC(Cl)=CC=C31)=O)C)C=CC=C2)CCCCCCC(O)=O)O
Tpsa: 115.22
Logp: 5.9401
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 15
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₃₇ClN₂O₆S
Molecular Weight:
565.12
Synonyms:
Tianeptine sodium impurity E [EP]
SMILES:
O=C(CCCCCCN(C1C2=C(N(S(=O)(C3=CC(Cl)=CC=C31)=O)C)C=CC=C2)CCCCCCC(O)=O)O
Tpsa:
115.22
Logp:
5.9401
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
15
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₃₆N₈O₅
Molecular Weight: 480.56
Synonyms: Dipyridamole Related Compound F (2,2',2'',2'''-({4-[(2-Hydroxyethyl)amino]-8-(piperidin-1-yl)pyrimido[5,4-d]pyrimidine-2,6-diyl}bis(azanetriyl))tetraethanol)
SMILES: OCCNC1=NC(N(CCO)CCO)=NC2=C1N=C(N(CCO)CCO)N=C2N3CCCCC3
Tpsa: 174.46
Logp: -1.6037
H Acceptors: 13
H Donors: 6
Rotatable Bonds: 14
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₃₆N₈O₅
Molecular Weight:
480.56
Synonyms:
Dipyridamole Related Compound F (2,2',2'',2'''-({4-[(2-Hydroxyethyl)amino]-8-(piperidin-1-yl)pyrimido[5,4-d]pyrimidine-2,6-diyl}bis(azanetriyl))tetraethanol)
SMILES:
OCCNC1=NC(N(CCO)CCO)=NC2=C1N=C(N(CCO)CCO)N=C2N3CCCCC3
Tpsa:
174.46
Logp:
-1.6037
H Acceptors:
13
H Donors:
6
Rotatable Bonds:
14
Purity: 98%
MDL No: MFCD11707218
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₉NO
Molecular Weight: 217.31
Synonyms: 4-tert-Butyl-3-hydroxy-2,6-xylylacetonitrile
SMILES: N#CCC1=C(C)C=C(C(C)(C)C)C(O)=C1C
Tpsa: 44.02
Logp: 3.37262
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD11707218
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₉NO
Molecular Weight:
217.31
Synonyms:
4-tert-Butyl-3-hydroxy-2,6-xylylacetonitrile
SMILES:
N#CCC1=C(C)C=C(C(C)(C)C)C(O)=C1C
Tpsa:
44.02
Logp:
3.37262
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₉Cl₂N
Molecular Weight: 308.25
Synonyms: Sertraline Impurity 3（Sertraline EP Impurity C）
SMILES: CN[C@@H]1C2=CC=CC=C2[C@H](C3=CC=C(C=C3)Cl)CC1.Cl
Tpsa: 12.03
Logp: 4.948
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₉Cl₂N
Molecular Weight:
308.25
Synonyms:
Sertraline Impurity 3（Sertraline EP Impurity C）
SMILES:
CN[C@@H]1C2=CC=CC=C2[C@H](C3=CC=C(C=C3)Cl)CC1.Cl
Tpsa:
12.03
Logp:
4.948
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
2