CS-0978660
5-(tert-Butoxycarbonyl)-3-(hydroxymethyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxylic acid
Manufacturer: ChemScene
CAS Number: 3024071-54-0
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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
C₁₄H₂₁N₃O₅
Molecular Weight
311.33
Synonyms
None
SMILES
O=C(O)C1=NN2C(=C1CO)CN(C(=O)OC(C)(C)C)CCC2
Tpsa
104.89
Logp
1.2144
H Acceptors
6
H Donors
2
Rotatable Bonds
2
SAFETY INFORMATION
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: C₁₄H₂₁N₃O₅
Molecular Weight: 311.33
Synonyms: None
SMILES: O=C(O)C1=NN2C(=C1CO)CN(C(=O)OC(C)(C)C)CCC2
Tpsa: 104.89
Logp: 1.2144
H Acceptors: 6
H Donors: 2
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:
C₁₄H₂₁N₃O₅
Molecular Weight:
311.33
Synonyms:
None
SMILES:
O=C(O)C1=NN2C(=C1CO)CN(C(=O)OC(C)(C)C)CCC2
Tpsa:
104.89
Logp:
1.2144
H Acceptors:
6
H Donors:
2
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: C₆H₃BrF₃NO₂S
Molecular Weight: 290.06
Synonyms: None
SMILES: O=C(OC)C=1SC(=NC1Br)C(F)(F)F
Tpsa: 39.19
Logp: 2.711
H Acceptors: 4
H Donors: 0
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:
C₆H₃BrF₃NO₂S
Molecular Weight:
290.06
Synonyms:
None
SMILES:
O=C(OC)C=1SC(=NC1Br)C(F)(F)F
Tpsa:
39.19
Logp:
2.711
H Acceptors:
4
H Donors:
0
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: C₈H₇ClN₂O
Molecular Weight: 182.61
Synonyms: None
SMILES: N#CC=1C=CC(=NC1Cl)OCC
Tpsa: 45.91
Logp: 2.00538
H Acceptors: 3
H Donors: 0
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:
C₈H₇ClN₂O
Molecular Weight:
182.61
Synonyms:
None
SMILES:
N#CC=1C=CC(=NC1Cl)OCC
Tpsa:
45.91
Logp:
2.00538
H Acceptors:
3
H Donors:
0
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: C₁₃H₂₁BN₂O₄
Molecular Weight: 280.13
Synonyms: None
SMILES: O=C(OCC)C1=NN(C=C1B2OC(C)(C)C(O2)(C)C)C
Tpsa: 62.58
Logp: 0.896
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₂₁BN₂O₄
Molecular Weight:
280.13
Synonyms:
None
SMILES:
O=C(OCC)C1=NN(C=C1B2OC(C)(C)C(O2)(C)C)C
Tpsa:
62.58
Logp:
0.896
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
3