CS-0532370
(6aR,9R,10aR)-7-Allyl-N9-(3-(dimethylamino)propyl)-N4-ethyl-6a,7,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-4,9(6H)-dicarboxamide Cabergoline Impurity
Manufacturer: ChemScene
CAS Number: 166533-36-4
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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
C₂₆H₃₇N₅O₂
Molecular Weight
451.60
Synonyms
N8-Desethylcarbamoyl-N1-ethylcarbamoyl Cabergoline
SMILES
CCNC(N1C2=C3C([C@]4([H])[C@@](N(C[C@@H](C4)C(NCCCN(C)C)=O)CC=C)([H])CC3=C1)=CC=C2)=O
Tpsa
69.61
Logp
2.803
H Acceptors
5
H Donors
2
Rotatable Bonds
8
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 166533-36-4 | N8-Desethylcarbamoyl-N1-ethylcarbamoylCabergoline | A2B Chem | ₹ 51,250.44 |
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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: C₂₆H₃₇N₅O₂
Molecular Weight: 451.60
Synonyms: N8-Desethylcarbamoyl-N1-ethylcarbamoyl Cabergoline
SMILES: CCNC(N1C2=C3C([C@]4([H])[C@@](N(C[C@@H](C4)C(NCCCN(C)C)=O)CC=C)([H])CC3=C1)=CC=C2)=O
Tpsa: 69.61
Logp: 2.803
H Acceptors: 5
H Donors: 2
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:
C₂₆H₃₇N₅O₂
Molecular Weight:
451.60
Synonyms:
N8-Desethylcarbamoyl-N1-ethylcarbamoyl Cabergoline
SMILES:
CCNC(N1C2=C3C([C@]4([H])[C@@](N(C[C@@H](C4)C(NCCCN(C)C)=O)CC=C)([H])CC3=C1)=CC=C2)=O
Tpsa:
69.61
Logp:
2.803
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
8
Purity: 98%
MDL No: MFCD27991776
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₆ClF₂N
Molecular Weight: 177.58
Synonyms: None
SMILES: FC(C1=NC=CC(Cl)=C1)(C)F
Tpsa: 12.89
Logp: 2.8467
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD27991776
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₆ClF₂N
Molecular Weight:
177.58
Synonyms:
None
SMILES:
FC(C1=NC=CC(Cl)=C1)(C)F
Tpsa:
12.89
Logp:
2.8467
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD25478503
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₄ClF₂NO
Molecular Weight: 179.55
Synonyms: 3-Chloro-5-difluoromethyl-pyridin-2-ol
SMILES: O=C1NC=C(C(F)F)C=C1Cl
Tpsa: 32.86
Logp: 1.9659
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD25478503
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₄ClF₂NO
Molecular Weight:
179.55
Synonyms:
3-Chloro-5-difluoromethyl-pyridin-2-ol
SMILES:
O=C1NC=C(C(F)F)C=C1Cl
Tpsa:
32.86
Logp:
1.9659
H Acceptors:
1
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: C₂₄H₃₂NO₆+
Molecular Weight: 430.51
Synonyms: Cis-Quaternary Acid
SMILES: COC(C=C(CC[N@+]1(C)CCC(O)=O)C([C@H]1CC2=CC(OC)=C(C=C2)OC)=C3)=C3OC
Tpsa: 74.22
Logp: 3.4822
H Acceptors: 5
H Donors: 1
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:
C₂₄H₃₂NO₆+
Molecular Weight:
430.51
Synonyms:
Cis-Quaternary Acid
SMILES:
COC(C=C(CC[N@+]1(C)CCC(O)=O)C([C@H]1CC2=CC(OC)=C(C=C2)OC)=C3)=C3OC
Tpsa:
74.22
Logp:
3.4822
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
9