CS-0142953
Uperolein
Manufacturer: ChemScene
CAS Number: 55601-63-3
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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
C₅₇H₇₉N₁₃O₁₆S
Molecular Weight
1234.38
Synonyms
None
SMILES
O=C(N(CCC1)[C@@H]1C(N[C@@H](CC(N)=O)C(N[C@@H](C)C(N[C@H](C(N[C@H](C(NCC(N[C@@H](CC(C)C)C(N[C@H](C(N)=O)CCSC)=O)=O)=O)CC(C=C2)=CC=C2O)=O)CC3=CC=CC=C3)=O)=O)=O)[C@H](CC(O)=O)NC([C@H](CCC4)N4C([C@@H](N5)CCC5=O)=O)=O
Tpsa
446.23
Logp
-3.3977
H Acceptors
16
H Donors
13
Rotatable Bonds
32
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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: C₅₇H₇₉N₁₃O₁₆S
Molecular Weight: 1234.38
Synonyms: None
SMILES: O=C(N(CCC1)[C@@H]1C(N[C@@H](CC(N)=O)C(N[C@@H](C)C(N[C@H](C(N[C@H](C(NCC(N[C@@H](CC(C)C)C(N[C@H](C(N)=O)CCSC)=O)=O)=O)CC(C=C2)=CC=C2O)=O)CC3=CC=CC=C3)=O)=O)=O)[C@H](CC(O)=O)NC([C@H](CCC4)N4C([C@@H](N5)CCC5=O)=O)=O
Tpsa: 446.23
Logp: -3.3977
H Acceptors: 16
H Donors: 13
Rotatable Bonds: 32
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₇H₇₉N₁₃O₁₆S
Molecular Weight:
1234.38
Synonyms:
None
SMILES:
O=C(N(CCC1)[C@@H]1C(N[C@@H](CC(N)=O)C(N[C@@H](C)C(N[C@H](C(N[C@H](C(NCC(N[C@@H](CC(C)C)C(N[C@H](C(N)=O)CCSC)=O)=O)=O)CC(C=C2)=CC=C2O)=O)CC3=CC=CC=C3)=O)=O)=O)[C@H](CC(O)=O)NC([C@H](CCC4)N4C([C@@H](N5)CCC5=O)=O)=O
Tpsa:
446.23
Logp:
-3.3977
H Acceptors:
16
H Donors:
13
Rotatable Bonds:
32
Purity: 98%
MDL No: MFCD04112489
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₃FN₂O₂
Molecular Weight: 142.09
Synonyms: Pyridine, 2-fluoro-4-nitro- (8CI, 9CI)
SMILES: O=[N+](C1=CC(F)=NC=C1)[O-]
Tpsa: 56.03
Logp: 1.1289
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD04112489
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₃FN₂O₂
Molecular Weight:
142.09
Synonyms:
Pyridine, 2-fluoro-4-nitro- (8CI, 9CI)
SMILES:
O=[N+](C1=CC(F)=NC=C1)[O-]
Tpsa:
56.03
Logp:
1.1289
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 97%
MDL No: MFCD14581171
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₈N₂O₂
Molecular Weight: 268.40
Synonyms: Tert-Butyl 3-(Piperidin-3-Yl)Piperidine-1-Carboxylate
SMILES: O=C(N1CC(C2CNCCC2)CCC1)OC(C)(C)C
Tpsa: 41.57
Logp: 2.6331
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
97%
MDL No:
MFCD14581171
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₈N₂O₂
Molecular Weight:
268.40
Synonyms:
Tert-Butyl 3-(Piperidin-3-Yl)Piperidine-1-Carboxylate
SMILES:
O=C(N1CC(C2CNCCC2)CCC1)OC(C)(C)C
Tpsa:
41.57
Logp:
2.6331
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD19700144
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₆N₂O₂
Molecular Weight: 254.37
Synonyms: 1-pyrrolidinecarboxylic acid, 3-(3-piperidinyl)-, 1,1-dimethylethyl ester
SMILES: O=C(N1CC(C2CNCCC2)CC1)OC(C)(C)C
Tpsa: 41.57
Logp: 2.243
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD19700144
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₆N₂O₂
Molecular Weight:
254.37
Synonyms:
1-pyrrolidinecarboxylic acid, 3-(3-piperidinyl)-, 1,1-dimethylethyl ester
SMILES:
O=C(N1CC(C2CNCCC2)CC1)OC(C)(C)C
Tpsa:
41.57
Logp:
2.243
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1