[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate

C94H104Br2F2N20O13 — CID 177459065

IUPAC[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate
SMILESC=Cc1c(C)c2cc3nc(c(CC(=O)OC)c4[nH]c(cc5nc(cc1[nH]2)C(C)=C5CC)c(C)c4C(=O)NCCN(CCNC(=O)CCc1cn(CCCCCC(=O)Oc2cc4ncnc(Nc5ccc(Br)cc5F)c4cc2OC)nn1)CCNC(=O)CCc1cn(CCCCCC(=O)Oc2cc4ncnc(Nc5ccc(Br)cc5F)c4cc2OC)nn1)[C@@H](CCC(=O)OC)[C@@H]3C
InChIInChI=1S/C94H104Br2F2N20O13/c1-11-61-53(3)71-44-73-55(5)63(25-30-85(121)128-9)90(108-73)66(43-88(124)129-10)91-89(56(6)74(109-91)46-78-62(12-2)54(4)72(107-78)45-77(61)106-71)94(125)101-33-38-116(36-31-99-83(119)28-23-59-49-117(114-112-59)34-17-13-15-19-86(122)130-81-47-75-64(41-79(81)126-7)92(104-51-102-75)110-69-26-21-57(95)39-67(69)97)37-32-100-84(120)29-24-60-50-118(115-113-60)35-18-14-16-20-87(123)131-82-48-76-65(42-80(82)127-8)93(105-52-103-76)111-70-27-22-58(96)40-68(70)98/h11,21-22,26-27,39-42,44-52,55,63,106,109H,1,12-20,23-25,28-38,43H2,2-10H3,(H,99,119)(H,100,120)(H,101,125)(H,102,104,110)(H,103,105,111)/b71-44-,72-45-,73-44-,74-46-,77-45-,78-46-,90-66-,91-66-/t55-,63-/m0/s1
InChIKeyQPPODJASVCXQEP-QWLXUSRPSA-N
MW1919.80 g/mol
LogP15.71
Rot. Bonds43

About [4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate

[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate (PubChem CID 177459065) has the molecular formula C94H104Br2F2N20O13 and a molecular weight of 1919.80 g/mol. Its IUPAC name is [4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate.

Molecular Properties

Compound Name[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate
PubChem CID177459065
Molecular FormulaC94H104Br2F2N20O13
Molecular Weight1919.80 g/mol
Exact Mass1916.64
IUPAC Name[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate
SMILESC=Cc1c(C)c2cc3nc(c(CC(=O)OC)c4[nH]c(cc5nc(cc1[nH]2)C(C)=C5CC)c(C)c4C(=O)NCCN(CCNC(=O)CCc1cn(CCCCCC(=O)Oc2cc4ncnc(Nc5ccc(Br)cc5F)c4cc2OC)nn1)CCNC(=O)CCc1cn(CCCCCC(=O)Oc2cc4ncnc(Nc5ccc(Br)cc5F)c4cc2OC)nn1)[C@@H](CCC(=O)OC)[C@@H]3C
InChIInChI=1S/C94H104Br2F2N20O13/c1-11-61-53(3)71-44-73-55(5)63(25-30-85(121)128-9)90(108-73)66(43-88(124)129-10)91-89(56(6)74(109-91)46-78-62(12-2)54(4)72(107-78)45-77(61)106-71)94(125)101-33-38-116(36-31-99-83(119)28-23-59-49-117(114-112-59)34-17-13-15-19-86(122)130-81-47-75-64(41-79(81)126-7)92(104-51-102-75)110-69-26-21-57(95)39-67(69)97)37-32-100-84(120)29-24-60-50-118(115-113-60)35-18-14-16-20-87(123)131-82-48-76-65(42-80(82)127-8)93(105-52-103-76)111-70-27-22-58(96)40-68(70)98/h11,21-22,26-27,39-42,44-52,55,63,106,109H,1,12-20,23-25,28-38,43H2,2-10H3,(H,99,119)(H,100,120)(H,101,125)(H,102,104,110)(H,103,105,111)/b71-44-,72-45-,73-44-,74-46-,77-45-,78-46-,90-66-,91-66-/t55-,63-/m0/s1
InChIKeyQPPODJASVCXQEP-QWLXUSRPSA-N
XLogP15.71
TPSA408.60 Ų
H-Bond Donors7
H-Bond Acceptors28
Rotatable Bonds43
Heavy Atoms131
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001919.80
LogP ≤ 515.71
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1028

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phenol_ester', 'substructure': 'N/A'}

Analyze [4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate with MolForge

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Related Compounds

methyl 3-[(22S,23S)-4-[[3-[2-[3-[[6,7-bis(2-methoxyethoxy)quinazolin-4-yl]amino]phenyl]ethynyl]phenyl]methyl]-17-(1-butoxyethyl)-12-ethyl-13,18,22,27-tetramethyl-3,5-dioxo-4,8,24,25,26-pentazahexacyclo[19.2.1.16,9.111,14.116,19.02,7]heptacosa-1,6,9(27),10,12,14(26),15,17,19(25),20-decaen-23-yl]propanoate
CID 162674473
[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,22,23-tetrahydroporphyrin-2-carbonyl]amino]methyl]triazol-1-yl]hexanoate
CID 132578090
N-[4-[4-[3-[[6,7-bis(2-methoxyethoxy)quinazolin-4-yl]amino]phenyl]triazol-1-yl]butyl]-3-[(21S,22S)-11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),5,8(26),10(25),12,15,17,19-octaen-22-yl]propanamide
CID 172046344
N-[4-[4-[3-[[6,7-bis(2-methoxyethoxy)quinazolin-4-yl]amino]phenyl]triazol-1-yl]butyl]-3-[(21S,22S)-11-ethyl-16-(1-hexoxyethyl)-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),5,8(26),10,12,15(24),16,19-octaen-22-yl]propanamide
CID 172049149
[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[[3-[[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]methoxy]-5-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethylcarbamoyl]phenoxy]methyl]triazol-1-yl]hexanoate
CID 177507636
[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[[3-[[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]methoxy]-5-[2-[2-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethoxy]ethoxy]ethylcarbamoyl]phenoxy]methyl]triazol-1-yl]hexanoate
CID 177544046
methyl 3-[(2S,3S)-18-[2-[6-[4-[[3-[[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxymethyl]-5-[[1-[6-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethylamino]-6-oxohexyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]hexanoylamino]ethylcarbamoyl]-8-ethenyl-13-ethyl-20-(2-methoxy-2-oxoethyl)-3,7,12,17-tetramethyl-2,3,22,24-tetrahydroporphyrin-2-yl]propanoate
CID 177608769
[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[[3-[2-[2-[[3,5-bis[[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]methoxy]benzoyl]amino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylcarbamoyl]-5-[[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]hexanoate
CID 177632224
methyl 3-[(23S)-17-[1-[[3-[2-[3-[[6,7-bis(2-methoxyethoxy)quinazolin-4-yl]amino]phenyl]ethynyl]phenyl]methoxy]ethyl]-4-butyl-12-ethyl-13,18,22,27-tetramethyl-3,5-dioxo-4,8,24,25,26-pentazahexacyclo[19.2.1.16,9.111,14.116,19.02,7]heptacosa-1,6,9(27),10,14,16(25),17,19,21(24)-nonaen-23-yl]propanoate
CID 137294094
methyl 3-[(23S)-4-[[3-[2-[3-[[6,7-bis(2-methoxyethoxy)quinazolin-4-yl]amino]phenyl]ethynyl]phenyl]methyl]-17-ethenyl-12-ethyl-18,22,27-trimethyl-3,5-dioxo-4,8,24,25,26-pentazahexacyclo[19.2.1.16,9.111,14.116,19.02,7]heptacosa-1,6,9(27),10,12,14(26),15,17,19(25),20-decaen-23-yl]propanoate
CID 153457522
methyl 3-[(23S)-4-[[3-[2-[3-[[6,7-bis(2-methoxyethoxy)quinazolin-4-yl]amino]phenyl]ethynyl]phenyl]methyl]-12-ethyl-17-(1-hexoxyethyl)-13,18,22,27-tetramethyl-3,5-dioxo-4,8,24,25,26-pentazahexacyclo[19.2.1.16,9.111,14.116,19.02,7]heptacosa-1,6,9(27),10,12,14(26),15,17,19(25),20-decaen-23-yl]propanoate
CID 153457523
N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine;N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[2-(triazol-1-yl)ethoxy]quinazolin-4-amine;N-[2-(diethylamino)ethyl]-5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide;3-[2,4-dimethyl-5-[(Z)-(2-oxo-1H-indol-3-ylidene)methyl]-1H-pyrrol-3-yl]propanoic acid;(3Z)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-1H-indol-2-one
CID 158221416

Frequently Asked Questions

What is the IUPAC name of [4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate?
The IUPAC name of [4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate (CID 177459065) is [4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate.
What is the SMILES notation for [4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate?
The canonical SMILES for [4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate is C=Cc1c(C)c2cc3nc(c(CC(=O)OC)c4[nH]c(cc5nc(cc1[nH]2)C(C)=C5CC)c(C)c4C(=O)NCCN(CCNC(=O)CCc1cn(CCCCCC(=O)Oc2cc4ncnc(Nc5ccc(Br)cc5F)c4cc2OC)nn1)CCNC(=O)CCc1cn(CCCCCC(=O)Oc2cc4ncnc(Nc5ccc(Br)cc5F)c4cc2OC)nn1)[C@@H](CCC(=O)OC)[C@@H]3C.
What is the InChIKey of [4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate?
The InChIKey is QPPODJASVCXQEP-QWLXUSRPSA-N. The full InChI is InChI=1S/C94H104Br2F2N20O13/c1-11-61-53(3)71-44-73-55(5)63(25-30-85(121)128-9)90(108-73)66(43-88(124)129-10)91-89(56(6)74(109-91)46-78-62(12-2)54(4)72(107-78)45-77(61)106-71)94(125)101-33-38-116(36-31-99-83(119)28-23-59-49-117(114-112-59)34-17-13-15-19-86(122)130-81-47-75-64(41-79(81)126-7)92(104-51-102-75)110-69-26-21-57(95)39-67(69)97)37-32-100-84(120)29-24-60-50-118(115-113-60)35-18-14-16-20-87(123)131-82-48-76-65(42-80(82)127-8)93(105-52-103-76)111-70-27-22-58(96)40-68(70)98/h11,21-22,26-27,39-42,44-52,55,63,106,109H,1,12-20,23-25,28-38,43H2,2-10H3,(H,99,119)(H,100,120)(H,101,125)(H,102,104,110)(H,103,105,111)/b71-44-,72-45-,73-44-,74-46-,77-45-,78-46-,90-66-,91-66-/t55-,63-/m0/s1.
What are the key properties of [4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate?
[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate has a molecular weight of 1919.80 g/mol, XLogP of 15.71, 43 rotatable bonds, 7 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl] 6-[4-[3-[2-[2-[3-[1-[6-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-6-oxohexyl]triazol-4-yl]propanoylamino]ethyl-[2-[[(17S,18S)-12-ethenyl-7-ethyl-20-(2-methoxy-2-oxoethyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-17,18,21,23-tetrahydroporphyrin-2-carbonyl]amino]ethyl]amino]ethylamino]-3-oxopropyl]triazol-1-yl]hexanoate is sourced from PubChem (CID 177459065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).